Acta Crystallographica Section A
Acta Crystallographica
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Volume 43| Part a1

ISSN: 2053-2733

August 1987 issue

Abstracts of the XIV IUCr Congress

Perth, Australia, 12-20 August 1987

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abstracts

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Crystallography in the life sciences

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Structure solution and refinement from neutron and synchrotron powder diffraction data

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Site-directed mutagenesis and structural studies to probe and modify enzyme action

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Surface atom localization by X-ray methods

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Zeolitic catalysts: the chemistry of cages and channels

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Small molecule crystallography: insight into biological activity

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Quasiperiodic crystals

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Lattice defects studied by high-resolution electron microscopy

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The structure of a bacterial photosynthetic reaction center

J. Deisenhofer and H. Michel

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Computer graphics in structure analysis

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X-ray characterization of superlattices and epitaxial layers

M. Sauvage-Simkin

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Structural correlations in three-dimensional network solids

F. C. Hawthorne

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Atomic mechanisms of structural phase transitions

K. S. Aleksandrov

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Techniques for large unit cells

J. R. Helliwell

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Multiwire area-detector arrays for data collection of crystals with large unit cells

N.-h. Xuong, C. Nielsen and V. Ashford

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Processing oscillation photographs of virus crystal diffracation data using the 'American method'

M. C. Rossmann, G. Vriend, M. Luo, E. Arnold, G. Kamer and T. J. Smith

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Image-plate protein data: an example of experiment with a Weissenberg camera using SR in the Photon Factory

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Synchrotron radiation Laue data collection for kinetic studies

D. Bilderback, K. Moffat, W. Schildkamp, D. Szebenyi, B. Smith Temple and K. Volz

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Greatly reduced radiation damage in ribonuclease crystals mounted on glass fibers

J. C. Dewan and R. F. Tilton

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Use of polychromatic synchrotron X-radiation in protein crystal Laue diffraction

R. Brammer, J. Campbell, I. Clifton, D. W. J. Cruickshank, M. Elder, T. J. Greenhough, G. Habash, M. M. Harding, J. R. Helliwell, P. Machin, P. R. Moore, A. W. Thompson and T. Wan

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Fiber diffraction as an alternative to protein crystallography

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X-ray crystallographic studies of human serum amyloid P-component (SAP)

G. Oliva, B. P. O'Hara, S. Wood, H. White, M. B. Pepys and T. L. Blundell

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Multiple-wavelength phase determination in protein crystallography

J. L. Smith, A. Pähler, H. M. Krishna Murthy and W. A. Hendrickson

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X-ray crystal structure analysis of 3α,20β-hydroxysteroid dehydrogenase from Streptomyces hydrogenans: a progress report

D. Ghosh, C. M. Weeks, W. A. Pangborn, J. S. Punzi, M. Erman, W. L. Duax and P. M. D. Fitzgerald

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Structure analysis of ω-amino acid: pyruvate aminotransferase from Pseudomonas sp. F-126

N. Watanabe, K. Sakabe, N. Sakabe, T. Higashi, K. Sasaki, S. Aibara, Y. Morita, K. Yonaha, S. Toyoma and H. Hukutani

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MERLOT: a package of computer programs for the determination of phases using the molecular replacement method

P. M. D. Fitzgerald

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Structural analysis of the complex of mung bean trypsin inhibitor with porcine trypsin at 2.8 Å resolution

G. D. Lin, J. C. Xuan, J. H. Fu, Y. W. Yan, R. G. Zhang, Z. W. Chi, T. Q. Tsao, Z. G. Chen, X. C. Wei, G. P. Li, G. Y. Lu, X. P. Dai and Y. Q. Tang

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Phase extension by combined use of solvent flattening and entropy maximization

E. Prince, L. Sjölin, R. Alenljung and A. Svensson

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SRLSQ refinement of triclinic lysozyme

M. Ramanadham, L. C. Sieker and L. H. Jensen

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The evaluation of solvent and salt density in protein crystallography: a neutron study

B. P. Schoenborn and X. Cheng

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Neutron structure analysis of plastocyanin

W. B. Church, T. P. J. Garrett, H. C. Freeman and B. P. Schoenborn

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A neutron and X-ray study of haemoglobin

D. A. Waller, S. A. Mason, R. C. Liddington, G. G. Dodson and E. J. Dodson

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The 'missing cone' problem in electron crystallography: interpretability of high-resolution density maps

R. M. Glaeser, L. Tong and S.-H. Kim

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Electron microscopy studies of protein crystals found in vivo

S. Hovmöller, D. N. Wang and A. Sjögren

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The structural consequences of site-directed mutations

R. Bott, M. Ultsch and A. Kossiakoff

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Studies of specificity and catalysis in trypsin by structural analysis of site-directed mutants

S. Sprang, T. Standing, R. J. Fletterick, L. Graf, W. J. Rutter and C. S. Craik

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Correlations between structure and thermodynamic stability of phage T4 lysozyme

T. Alber, J. Bell, S. Cook, J. A. Nye, S. Daopin, K. Wilson, J. Wozniak and B. W. Matthews

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Yeast tRNA(ASP)–aspartyl–tRNA synthetase complex at 7 Å resolution

D. Moras, J. Cavarelli, A. Mitschler, A. Podjarny, B. Rees, J. C. Thierry, J. P. Ebel, B. Lorber and R. Giegé

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The trp repressor/operator system: the crystallography of ligand-activated genetic regulation

R. W. Schevitz, A. Joachimiak, R.-G. Zhang, C. L. Lawson, R. Q. Marmorstein, Z. Otwinowski and P. B. Sigler

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Sequence-dependent DNA recognition; crystallographic studies of DNaseI:oligonucleotide complexes

A. Lahm and D. Suck

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Structural basis of the action of thermolysin and the zinc proteases

H. M. Holden, D. E. Tronrud, A. F. Monzingo, L. H. Weaver and B. W. Matthews

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Molecular dynamics as a tool in calculating binding energies

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Prediction of the conformation of short segments of polypeptide chain in proteins

J. Moult and M. N. G. James

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Antibody–antigen recognition: the structure of a Fab–lysozyme complex

A. G. Amit, R. A. Mariuzza, S. E. V. Phillips and R. J. Poljak

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Crystal structure of ricin-OR. One of two toxins isolated from castor beans

W. R. Chang, L. Chen, J. Rose, C. H. Wei, M. Sax and B. C. Wang

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The crystal structure of an anti-arsonate antibody

M. B. Lascombe, P. M. Alzari, P. Saludjian and P. Tougard

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Characterization of Fab fragments from murine monoclonal antibodies with activity toward single-stranded DNA or fluorescein

A. B. Edmundson, J. N. Herron, X.-M. He, A. L. Gibson and E. W. Voss Jr

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The crystal structure of Fab NQ10

P. M. Alzari, R. A. Mariuzza, P. Saludjian and R. J. Poljak

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Pronounced effect of the solvent of crystallization on the structure of a multi-domain protein

C.-H. Chang, W. E. Carperos, C. F. Ainsworth, K. W. Olsent and M. Schiffer

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Crystallization and crystallographic study of pig liver NADH-cytochrome b₅ reductase

K. Miki, S. Kaida, N. Kasai, T. Iyanagi, K. Kobayashi and K. Hayashi

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Crystallization of a copper-containing nitrite reductase

E. T. Adman, S. Turley, L. C. Sieker and J. LeGall

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Crystal structure of Cd,Zn metallothionein at 1.9 Å resolution

S. A. Collett and C. D. Stout

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Improved purification, crystallization, and X-ray study of hydrogenase of sulfate-reducing bacterium

Y. Higuchi, N. Yasuoka, M. Kakudo, Y. Katsube, T. Yagi and H. Inokuchi

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The structure of the neuraminidase glycoprotein of influenza virus (Tokyo/3/67) at 2.4 Å resolution

J. N. Varghese, P. M. Colman, W. G. Laver and R. G. Webster

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The three-dimensional structure of neuraminidase of subtype N9

A. T. Baker, J. N. Varghese, W. G. Laver, G. M. Air, R. G. Webster and P. M. Colman

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Structural studies of D-xylose isomerase from S. rubiginosus at 2.5 Å resolution

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Structural similarity between peanut lectin and concanavalin A

S. C. Mande, S. Raghunathan, M. Islam Khan, A. Surolia and M. Vijayan

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Crystallographic analysis of Griffonia simplicifolia lectin IV and its complex with a synthetic Lewis b blood group determinant

M. Vandonselaar, L. T. J. Delbaere, J. W. Quail, U. Spohr and R. U. Lemieux

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The three-dimensional structure of trichosanthin

K. Pan, Y. Lin, Z. Fu, K. Zhou, Z. Cai, Z. Chen, Y. Zhang, Y. Dong, S. Wu, X. Ma, Y. Wang, S. Chen, J. Wang, X. Zhang, C. Ni, Z. Zhang, Z. Xia, Z. Fan and G. Tian

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Crystallographic study of a monoclonal Fab fragment specific for HPr of the phosphoenolpyruvate:sugar phosphotransferase system (PTS) of E. coli

L. Prasad, M. Vandonselaar, J. S. Lee and L. T. J. Delbaere

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Crystallographic analysis of the calcium calmodulin/trifluoperazine complex

L. T. J. Delbaere, L. M. B. Gehrig, M. Vandonselaar, J. W. Quail and R. A. Hickie

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A comparative molecular model of the Ca²⁺ sensitive regulatory protein calmodulin based on turkey skeletal troponin-C

N. C. J. Strynadka and M. N. G. James

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The crystal structure of manganese superoxide dismutase from Bacillus stearothermophilus

M. W. Parker and C. C. F. Blake

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Human carbonic anhydrase I–iodide complex: structure and inhibition mechanism

V. Kumar, P. Satyamurthy and K. K. Kannan

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Structural flexibility in ribonucleases

L. Mazzarella, S. Capasso, C. A. Mattia, G. Di Lorenzo and A. Zagari

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Three-dimensional structure of guanyl-specific ribonucleases from microorganisms at high resolution

B. K. Vainshtein, A. G. Parlovsky, K. M. Polyakov, S. N. Borisnova, B. V. Strokopytov and A. A. Vagin

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Crystal structure of β-lactamase from Staphylococcus aureus PC1 at 2.5 Å resolution

O. Herzberg and J. Moult

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The crystal structure analysis of xylanase from Bacillus pumilus IPO

Y. Hata, H. Yamaguchi, H. Moriyama, M. Sato, N. Tanaka, H. Okada and Y. Katsube

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Refined structures of D-galactose binding protein from E. Coli and its mutant reveal sugar, calcium and transducer binding sites

N. K. Vyas, M. N. Vyas, G. Y. Lu and F. A. Quiocho

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The structure of α-amylase inhibitor from wheat

N. Tanaka, Y. Kato, K. Maeda, M. Sato, Y. Katsube, Y. Hata, H. Matsubara and T. Takano

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A comparison of two crystal forms of bovine β-lactoglobulin

S. G. Hambling, S. Yewdell, A. C. T. North and L. Sawyer

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The 1.75 Å resolution structure of chloramphenicol acetyltransferase

A. G. W. Leslie and W. V. Shaw

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Crystallographic studies on bovine heart cytochrome c oxidase

S. Yoshikawa, T. Tera, Y. Takahashi, T. Tsukihara and W. S. Caughey

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The structure of yeast enolase

L. Lebioda, B. Stec and J. M. Brewer

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Tertiary structural similarity between a class A β-lactamase and a penicillin-sensitive D-alanyl carboxypeptidase-transpeptidase

R. J. Todd, B. J. Sutton, P. J. Artymiuk, C. B. Baguley and D. C. Phillips

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Small-angle X-ray scattering from annelid hemoglobin in solution

C. F. de Souza, I. L. Torriani, C. F. S. Bonafé and N. C. Meirelles

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Preliminary studies on tumor necrosis factor (TNF)

A. Bentley, G. Bricogne, R. Fourme, T. Prangé, P. Vachette, W. Fiers and J. Tavernier

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Theoretical calculation of relative affinities in protein–substrate binding

H. Luecke and F. A. Quiocho

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Iron–sulfur cluster in aconitase at 3.0 Å resolution

A. H. Robbins and C. D. Stout

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Crystallization and heavy-atom derivatives for cholesterol oxidase

A. Vrielink and D. M. Blow

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Papain–heptapeptide complexes

F. R. Ahmed, S. Hasnain, C. P. Huber, A. C. Storer, K. I. Varughese and G. Willick

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Lysine/fibrin binding sites of kringles modelled after the structure of prothrombin fragment 1

A. Tulinsky, C. H. Park, B. Mao and M. Llinas

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Crystal structure of a bovine neurophysin II dipeptide amide complex at 3 Å resolution

J. P. Rose, D. S. C. Yang, W. Furey Jr, C. S. Yoo, M. Sax, E. Breslow and B.-C. Wang

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The crystal structure and immunological cross-reactivity of monellin and thaumatin, two intensely sweet proteins

C.-H. Kang, A. de Vos, C. Ogata, M. Hatada, G. Tomlinson, W.-C. Shin and S.-H. Kim

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Structural studies on serum transferrin: the central protein of iron metabolism

S. Bailey, H. Jhoti, R. Garratt, B. Gorinsky, P. Lindley, R. Sarra, R. Evans and S. Hasnain

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The structure of human lactoferrin at 3.2 Å resolution

B. F. Anderson, E. N. Baker, H. M. Baker, G. E. Norris, S. V. Rumball, J. M. Waters and E. Dodson

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The crystal structure of 4-Zn rhombohedral des-B30 cross-linked human insulin

U. Derewenda, Z. Derewenda, G. G. Dodson and J. Markusson

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A new crystal form of insulin

Z. H. Rao and N. W. Isaacs

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Crystal structures of Bowman–Birk protease inhibitor and its complex with trypsin

Y. Tsunogae, A. Suzuki, I. Tanaka, T. Yamane and T. Ashida

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The crystal structures of (D-Trp)^Al-insulin and (L-Trp)^Al-insulin

D. C. Liang and Z. L. Wan

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Structure of a low-potential [4Fe–4S] ferredoxin determined by anomalous scattering of native iron atoms

K. Fukuyama, Y. Nagahara, T. Tsukihara, Y. Katsube, T. Hase and H. Matsubara

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A 3D model of phosphoribosyl transferase

B. Busetta and M. Hospital

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Crystallization of the complex of Momodica charantia L. trypsin inhibitor (MTI-1) with porcine trypsin

Q. Huang, Z. Chen, G. Li, Y. Tang, R. Qian, F. Zeng and Y. Wang

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Crystal structure determination and molecular model of mung bean trypsin inhibitor lys active fragment–bovine trypsin (MBILF–BTRY) complex at 3.0 Å resolution

Z. Chen, G. Li, J. Zeng, Y. Tang, G. Lu, X. Wei, G. Lin, R. Zhang, J. Xuan, Z. Chi and T. Tsao

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X-ray crystallographic studies on the complex of mung bean trypsin inhibitor with porcine trypsin

G. Li, Z. Chen, J. Zeng, Y. Tang, G. Lin, R. Zhang, J. Xuan, Z. Chi and T. Tsao

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Modelling of antibodies and their antigen complexes: towards an understanding of antibody–antigen interactions

J. C. Cheetham, S. Roberts and A. R. Rees

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The structure of a complex between influenza virus neuraminidase and an antibody

P. M. Colman, J. N. Varghese, A. T. Baker, P. A. Tulloch, W. G. Laver, G. M. Air and R. G. Webster

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The 2.5 Å crystal structure of a potent human renin inhibitor (A63218) bound to porcine pepsin

J. Erickson, C. Abad-Zapatero, T. J. Rydel and J. Luly

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Structural studies on the lens β, γ crystallins

B. Bax, M. Bibby, T. Blundell, H. Driessen, P. Lindley, L. Miller, D. Moss, S. Mylvaganam, S. Najmudin, C. Slingsby and H. White

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Protein–protein recognition: the interfaces of protein inhibitors and the serine proteinases

M. N. G. James, A. R. Sielecki, R. J. Read, M. Fujinaga, C. A. McPhalen and H. Greenblatt

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Structural studies of DNA fragments with base pair mismatches

O. Kennard and W. N. Hunter

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Possible role of protonation–deprotonation in nucleic acid breathing: a half-sandwich of water molecule in a trinucleotide complex of (A⁺p⁻Ap⁻A⁺)·(Ap⁻A⁺p⁻A⁺)

B. Parthasarathy, T. Srikrishnan and S. M. Fridey

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The Z-DNA compatible sequence d(GTGTACAC) crystallizes as A-DNA

S. Jain, G. Zon and M. Sundaralingam

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Nucleic acid junctions and macromolecular design

N. C. Seeman, C. J. Newton, M. L. Petrillo, J.-H. Chen, J. E. Mueller, J. A. Maiorella, R. D. Sheardy, R.-I. Ma and N. R. Kallenbach

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Visualisation of relationship of symmetry, conformation in biological macromolecular structure and function - a typical case of poly(C) and its analogs

A. C. Gomes, G. Biswas, R. Lalwani, S. Chakraborty, K. Bera and A. Banerjee

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Transition topology of gene structure – a generalised DNA model with dual role in DNA phase transition

R. Lalwani, S. Chakraborty and A. Bannerjee

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Crystallography of intact ribosomal particles

A. Yonath, K. S. Bartels, F. Frolow, H. Hope, C. Kratky, I. Makowski, S. Weinstein and H. G. Wittmann

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Crystals of gramicidin A

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Studies of structural modifications induced by γ-irradiation on distearoylphosphatidylcholine liposomes

G. Albertini, E. Fanelli, L. Guidoni, F. Ianzini, P. Mariani, R. Masella, F. Rustichelli and V. Viti

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Calculation of the vibrations of helical structures in polypeptides

E. Höhne and H. Sklenar

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Catalysis in the crystal: synchrotron radiation studies with glycogen phosphorylase b

K. R. Acharya, J. Hajdu, D. I. Stuart, P. J. McLaughlin, D. Barford, N. G. Oikonomakos and L. N. Johnson

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Crystal structures of the oxidized intermediate of cytochrome c peroxidase and its decay product

S. Edwards, D. Anderson, J. Kraut and Ng. H. Xuong

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Dynamics of nucleosides, nucleotides and peptides: some preliminary results

P. Sudarsanam, J. C. Sy, N. Ramasubbu, T. Srikrishnan and R. Parthasarathy

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The use of normal modes in thermal parameter refinement

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Reaction pathway of aspartic proteinases supported by substrate analogue binding to penicillopepsin

A. R. Sielecki, N. C. J. Strynadka and M. N. G. James

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Water networks in the crambin crystal structure

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Neutron diffraction study of γ-cyclodextrin·14D₂O at 110 K

V. Zabel, B. E. Hingerty, S. A. Mason and W. Saenger

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The structures of antiviral compounds/rhino virus 14 complexes

T. J. Smith, M. J. Kremer, M. Luo, G. Vriend, E. Arnold, G. Kamer, M. C. Rossmann, I. Minor, J. P. Griffith, M. A. McKinlay, G. D. Diana and M. J. Otto

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The structure of DNA and how small molecules recognize it: observations at near-atomic resolution

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An approach to modelling specificity determinants in receptor ligand complexes

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Experimental charge distributions and electrostatic potentials in chemical design

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Molecular mechanics as an accompaniment to X-ray crystallography in the study of drug action

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Crystal structures of transition-state analogues of GABA-transaminase inhibitors

J. M. Gulbis and M. F. Mackay

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Studies of potent benzamide anticonvulsants: the importance of chirality to toxicity and activity

N. E. Duke and P. W. Codding

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Study of structure–activity relationship for some isomers of cinnamamides

X. Xu, Y. Guan, Y. Tang and S. Wang

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Mapping the β-carboline binding site on the benzodiazepine receptor oligomer

P. W. Codding, M. B. Szkaradzinska, J. M. Cook and T. J. Hagen

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Structure–activity relationships of bipyridine inotropic cardiac agents

V. Cody, J. Luft, F. B. Davis and P. J. Davis

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The spatial arrangement of important molecular features in class 1 anti-arrhythmic agents

M. L. Glowka and P. W. Codding

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Conformational aspects of UL-FS 49, a new specific bradicardic agent

P. Luger, P. Müller, M. Reiffen and A. Prox

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Structure–activity relationship in furocoumarin derivatives

F. Benetollo, G. Bombieri, A. Del Pra and L. Mosti

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Crystal and molecular structure of 1,4-dihydro-6-methoxy-7-benzoyloxy isocoumarin

K. Sivakumar, K. Subramanian and S. Natarajan

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The structures of ω-phenyalalkyl derivatives of purine cytokinin

H. Mizuno, N. Nishikawa, Z. Kumazawa and N. Kashimura

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The crystal and molecular structure of alpha and beta nalbuphine

S. Z. Goldberg, M. Insler and R. E. Lippmann

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Metastable crystalline state of disodium adenosine 5′-triphosphate

Y. Suguwara, T. Ito, N. Kamiya, H. Iwasaki and Y. Satow

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Ternary metal complexes with deoxyribonucleotides. X-ray structures of nickel(II) ethylenediamine-2′-deoxyguanosine 5′-monophosphate and copper(II) benzimidazole-2′-deoxyguanosine 5′-monophosphate

N. Shahina Begum, M. Damodara Poojary and H. Manohar

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Parallel packing of alpha-helices in crystals of Boc-Trp-Ile-Ala-Aib-Ile-Val-Aib-Leu-Aib-Pro-Ala-Aib-Pro-Aib-Pro-Phe-OMe·4H₂O·2CH₃OH

I. L. Karle, J. Flippen-Anderson, M. Sukumar and P. Balaram

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Crystal structure and molecular conformation of a tripeptide N-Boc-L-Phe-dehydro-Phe-L-Val-OCH₃

T. P. Singh, M. Haridas, V. S. Chauhan and A. Kumar

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Renin inhibitors: structural study regarding statine in linear oligopeptides

G. Précigoux, S. Geoffre and M. Hospital

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Conformational analysis of angiotensinogen fragments

S. Geoffre, M. Benkoulouche, M. Cotrait and G. Précigoux

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Structural study of novel ACE inhibitor K26

N. Hirayama, M. Kasai and K. Shirahata

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The molecular structure of didemnin B, an antiviral and cytotoxic depsipeptide

M. B. Hossain, D. van der Helm, J. Antel, G. M. Sheldrick, S. K. Sanduja and A. J. Weinheimer

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The crystal structure of destruxin B

J. L. Rios Steiner and C. L. Barnes

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The conformation of thioamide-containing peptides

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Preferred conformational states of glycine-containing peptides

E. Subramanian and V. Ganesh

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The characterization of various crystalline forms of aspartame (a dipeptide sweetener)

N. Nagashima, C. Sano, S. Kishimoto and Y. Iitaka

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Structure and conformation of a nucleoside analog 5-nitro-AraU

G. Biswas and A. Banerjee

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Crystal structure of a synthetic antileukaemic agent - 5,5′,10,10′-dioxo-1,1′,3,3′-tetraphenyl-10,10′-bi(benz(G)isoquinoline), C₅₀N₂O₂H₃₂

V. G. Thailambal and V. Pattabhi

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The structure of the anticancer compound N-1′-ethyl-1,8-naphthaloimide-2′-dimethyl ammonium chloride, and the structures of its PtCl₄²⁻ and PtCl₆²⁻ salts

G. R. Clark and S. B. Hall

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Axastatin A, an antitumor agent from the marine sponge Axanilla sp.

R. B. Bates, M. A. Bruck, F. A. Camou, C. L. Herald, J. E. Leet, G. R. Pettit and D. Schaufelberger

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Visnagin, C₁₃H₁₀O₄ (5-methoxy-2-methyl-furo-(9)-chromen)

K. El-Sayed, A. M. Abd El-Rahman and H. L. Ammon

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Metal–drug interactions: structure, conformation and properties of cobalt complex of a peptide-resembling portion of antitumor antibiotic bleomycin

S. K. Arora and P. K. Mascharak

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Molecular structures of manzamine A, B, and C, three new alkaloids from Halicona sp.

G. Bernardinelli, C. W. Jefford, R. Sakai and T. Higa

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Antifungal compounds isolated from New Zealand plants

H. E. Harvey, J. M. Waring and G. J. Gainsford

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The crystal structures of O⁶-acetylmorphine and O⁶-acetylmorphine–ethyl acetate complex

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Structure of the cognition activator 3-phenoxypyridinium hydrogensulfate

C. Bandoli, U. Casellato, M. Nicolini and G. C. Pappalardo

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Molecular structure analysis of some 1,4-benzodiazepines

N. M. Blaton, O. M. Peeters, C. L. Verlinde and C. J. De Ranter

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The crystal and molecular structure of sulphinpyrazone, Ca·C₂₃H₂₀N₂O₃S·H₂O

H. C. Patel and T. P. Singh

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Crystal and molecular structure of N₄-acetyl-N¹-(p-nitrophenyl)sulphanilamide

M. Ghosh, A. K. Basak, S. K. Mazumdar and B. Sheldrick

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Crystal structures of molecular complexes involving sulfonamides and 9-aminoacridine

C. Chakrabarti, S. Ghose and J. K. Dattagupta

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Structural studies on immuno-modulators

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The biosides of Digitalis lanata

K. Go and K. Bhandary

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Structural factors governing agonist and antagonist activity in the GABA_A system

G. W. Pooler and E. G. Steward

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The crystal structure of anisatin, a potent convulsant

J. M. Gulbis and M. F. Mackay

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Structure of a sympathomimetic amine, hordenine sulfate, (C₁₀H₁₅NO)₂·H₂SO₄·2H₂O

S. Ghose and J. K. Dattagupta

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Molecular recognition in strychnine alkaloid salts

R. O. Gould, P. Taylor and M. D. Walkinshaw

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Models for the binding to DNA of cis-platinum derivatives containing bidentate tertiary amines

M. R. Taylor, S. L. Birch, S. E. Lawton, L. J. Keefe, L. M. Vilkins and J. D. Orbell

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Picrates of acetylcholine methoxycarbonylcholine

K. Frydenvang and B. Jensen

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The crystal and molecular structure of rotenone

M. Rossi, P. Fule and M. R. Taylor

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Crystal and molecular structure of maltitol

Y. J. Park and J. M. Shin

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Conformational characterization of shiromodiol derivatives

G. Appendino, M. Calleri, G. Chiari, P. Ugliengo and D. Viterbo

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Molecular compounds and complexes – current developments in perspective

F. H. Herbstein

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Inclusion compounds – an overview

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Crystalline complexes involving amino acids and peptides

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Cyclodextrin inclusion compounds

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Chiral interaction and fine structural fit in cyclodextrin clathrates

N. Rysanek, G. Le Bas, F. Villain, E. Hadjoudis, I. Moustakali-Mavridis and G. Tsoucaris

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Drug–Z-DNA interactions: crystal structure of deoxy CpG–mitoxantrone complex

M. A. Viswamitra and B. Ramakrishnan

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The first determination of the energy difference between solid-state conformers by X-ray diffraction. 1. The crystal structure of the pseudo-Jahn–Teller complex (nitrito)bis(2,2′-bipridyl)copper(II) nitrate at 20, 100, 165, and 296 K. 2. The possibility of using X-ray diffraction to characterize adiabatic potential energy surfaces and relative ligand strengths

C. J. Simmons, B. J. Hathaway, B. D. Santarsiero and A. Clearfield

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Structure-function relationships in Z-PR₃ compounds

B. J. Dunne, R. B. Morris and A. G. Orpen

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On the lattice packing rules revealed by the pairs of quasi-isostructural cardenolides and analogous bufadienolides

A. Kálmán, G. Argay, V. Fülöp, B. Ribár and D. Lazar

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Confirmation of diphenylsulphide derivatives

M. Ratajczak-Sitarz, A. Katrusiak and Z. Kałuski

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The relationship between the Br⋯O separation and Br—C—C=O torsion angle in alpha-bromocyclohexanone rings

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Transition metal–carbon bond distances and a revision of covalent radii

A. S. Batsanov and Yu. T. Struchkov

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Crystalline polysilicic acids esters with cage-like structures

Yu. I. Smolin, Yu. F. Shepelev and D. Hoebbel

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Comparative studies on the crystal structures of the perovskites CaRuO₃ and SrRuO₃

A. Reller, H. Schmalle and W. Bensch

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4-Phenyl pyridine: a new ligand in Werner clathrates

L. R. Nassimbeni and M. W. Taylor

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Solid-state N-bromosuccinimide–bromide complexes

J. Albertsson and C. Svensson

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Host–guest interactions in Werner clathrates

L. R. Nassimbeni, M. H. Moore and M. L. Niven

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The formation and ordering of crystallographic shear planes in non-stoichiometric TiO_2−x

A. N. Cormack, C. R. A. Catlow and C. M. Freeman

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Structural investigations of organometallic catalysts, catalyst precursors and ligands

K. Angermund and C. Krüger

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Molecular structure of the intermediate of the Staudinger reaction

A. N. Chernega, M. Yu. Antipin and Yu. T. Struchkov

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Thermal decomposition of tricyanomethanides

B. J. Poppleton

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Reaction pathway in the photoconversion of tetrahydroanthracenedione to its solid-state photo-product

S. Ariel, S. H. Askari, J. R. Scheffer, J. Trotter and F. Wireko

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Rate acceleration due to hydrogen bond of reactive group in the solid-state photoreaction

Y. Ohashi, E. Shimizu and K. Hori

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Studies of a solid-state racemerization reaction

R. Norrestam and B. W. Christensen

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A novel solid-state Diels–Alder reaction

G. R. Desiraju and K. V. Radha Kishan

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Intramolecular motion and conformational isomerization: structure of octachlorocyclophosphazene

G. S. Murthy, T. N. Guru Row and K. Venkatesen

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Phases and thermal decomposition characteristics of hydro-sodalites Na_6+x[AlSiO₄]₆(OH)_x·nH₂O

Ch. Buhl, J. Felsche and S. Luger

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Al vacancies in α-Al₂O₃ formed by dehydration of α-AlOOH

K. Hagiya and M. Ohmasa

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Surface structure of supported bimetallic catalysts

P. L. Gai, B. C. Smith and W. G. Waddington

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Molecular separations by lattice inclusion

I. Goldberg and F. Toda

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Crystal structures of hexakis(2,6-di-O-methyl)-α-cyclodextrin inclusion complexes

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Chiral discrimination and the crystal structures of pairs of diastereoisomeric salts

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Optical resolution of bicyclic cyanohydrins. The structure of the hydrogen-bonded brucine–cyanohydrin complex derived from (+)-norbornenone

A. A. Pinkerton, P.-A. Carrupt and P. Vogel

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Magnesium bis(hydrogen maleate) hexahydrate, by neutron diffraction and ab initio calculations

F. Vanhouteghem, A. T. H. Lenstra, H. J. Geise and P. Schweiss

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The stereochemistry of the hydrogen bonding of water molecules in the crystal structures of small-molecule nucleic acid components

G. A. Jeffrey and H. Maluszynska

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Bond valence versus O⋯O distance in hydrogen bonds

G. Ferraris and G. Ivaldi

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Synthesis and structural characterization of hydrated N,N′-diaryl- and N,N′-dicyclohexylpiperazine N,N′-dioxides

C.-K. Kwok and T. C. W. Mak

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Lattice sums and the Madelung constant: Ewald in America

D. H. Templeton

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Nonlinear optic properties, structure and phase transitions in ferroic crystals

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Diffuse scattering and phase transitions

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The initial interaction of oxygen with the nickel(110) surface – a scanning tunneling microscopy (STM) investigation

E. Ritter, J. Wintterlin and R. J. Behm

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Optical activity of the incommensurate phase of Rb₂ZnCl₄

K. Saito and J. Kobayashi

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Pressure-induced phase transition in As

T. Kikegawa and H. Iwasaki

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Short-range order and decomposition in nickel alloys

A. Cerri, F. Klaiber, G. Kostorz, L. Reinhard and B. Schönfeld

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Effect of hydrogenation on solid solutions of transition metals

V. F. Degtyareva, D. N. Mogilyansky and V. Sh. Shekhtman

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Lattice expansion as a function of self-irradiation for ²³⁹PuB₆

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Effect of internal strains on X-ray diffraction patterns of BaTiO₃

K. Irie, H. Nakamura, N. Ohnishi and A. Okazaki

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The polymorphism phase transition of LiIO₃ crystal and the relative stability of α, β and ζ phase

J. Liang and G. Rao

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Studies on phase transition of LiCdBO₃

Z. Zhou, Q. Huang, J. Liang, W. Lin and X. Yin

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Conformational ordering in tetrahedral zweier single chains: four successive phase transitions in KPO₃

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Electron diffraction studies of mixed-valence hollandites and structural transition in CsTi₈O₁₆

J. L. Hodeau, E. Fanchon, J. Vicat, P. Strobel and J. A. Watts

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Jahn–Teller cooperative effect and ferroelectric phase transitions of complex metal oxides with perovskite-type structure

Yu. N. Venevstev, D. F. Dzmuhadze, N. V. Fadeeva and S. A. Ivanov

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Investigation of low-temperature cation ordering ZrO₂–TiO₂–SnO₂ solid solutions

A. H. Lee, R. Kudesia and A. E. McHale

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The structural phase transition of thallium selenate at 72 K

P. Seidel and W. Hoffmann

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Degree of order in 'high-temperature' modifications of silica framework structures: relationships to 'low-temperature' frameworks

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A high-temperature neutron diffraction study of the anharmonicity and structural instability below the ortho-proto phase transition in enstatite, Mg₂Si₂O₆

N. Haga, S. Ghose and R. K. McMullen

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New observations on the low-temperature phase transitions in KLiSO₄

H.-D. Jennissen, P. Willms, J. Glinnemann, H. Klapper and Th. Hahn

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High-pressure phase transition of BeGa₂O₄ to olivine type structure

H. Tabata, M. Nachida and E. Ishii

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The hexagonal phases of (CH₃)₃NHCdCl₃ or how to minimize order–disorder effects

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Disorder and diffuse scattering in 1-D systems: diethylphenazinium iodide (E₂PI_1.6), K-hollandite (K_1.54Mg_0.77Ti_7.23O₁₆

U. Wildgruber, E. Roßhirt, F. Frey and H. Boysen

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Study of the disordered structure of p-iodotoluene using non-bonded interatomic potentials

S. K. Talapatra, S. Maity and S. B. Sarkar

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X-ray diffuse scattering study of spatial correlations in para-terphenyl

T. R. Welberry and S. L. Mair

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Order–disorder phase transitions: the crystal structure of the 1:1 donor:acceptor complex between anthracene and tetrachlorophthalic anhydride as a function of temperature

J. J. Stezowski, R.-D. Stigler, W. Mühle and J. U. von Schütz

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Structural phase transitions in chloroalkylammonium metallates

H. Fuess, I. Pabst, M. Körfer, H. Ben Ghozlen and M. Czjzek

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Characterization of the phase types of a series of peralkanoylated glucopyranosides: chiral nonaromatic disk-shaped molecules which form columnar phases

N. L. Morris, R. G. Weiss and G. B. Jameson

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Molecular disorder in ice Ih near the melting point by single-crystal neutron diffraction

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Structural behaviour of NiS₂ up to 5.4 GPa

T. Fujii, F. Marumo and K. Tanaka

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Effects of electric field on incommensurate–commensurate phase transitions of (NH₄)₂SO₄-group crystals

M. Ozeki, T. Kimura and Y. Tsutsumi

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Formation and transformation of biological calcium phosphates: effects of calcium, magnesium and phosphate

P.-T. Cheng and J. J. Grabher

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Displacive transitions in willhendersonite, a zeolite with a flexible chabazite-type framework

N. H. W. Sieber, R. X. Fischer and E. Tillmanns

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Structural deformation of experimentally shock-loaded forsterite (Mg₂SiO₄)

H. Schneider and E. Tillmanns

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On the martensitic phase transformation proto-clino enstatite

H. Schrader, H. Boysen, F. Frey, P. Convert and G. Eckold

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The modulated structure of quartz intermediate phase between α and β phases

K. Gouhara and N. Kato

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High-pressure structural studies of the phase transitions in PbTiO₃ and H₂C₄O₄

R. J. Nelmes, R. Ramirez, R. Restori and Z. Tun

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Martensitic phase transformation of single-crystal lithium from bcc to a 9R-related structure

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Optical activity and crystal structure

A. M. Glazer, M. Koralewski, K. Stadnicka and P. A. Thomas

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Bilayer structures of azobenzene-containing amphiphiles and their batho- or hypsochromic shifts in absorption spectra

K. Okuyama, M. Shimomura, K. Hirabayashi, T. Kajiyama, T. Kunitake and N. Yasuoka

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Circular dichroism of Ca₂Sr(C₂H₅CO₂)₆ family crystals

Y. Uesu, M. Sekiguchi and M. Inoue

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Simultaneous measurements of the electrogyration and electrooptic effects of α-quartz

T. Asahi, S. Takahashi and M. Takada

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Studies on push–pull ethylenes as nonlinear optical materials

D. Kanagapushpam and K. Venkatesan

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X-ray structural study of low-temperature phase of potassium cyanide

Y. Yoshimura and K. Shimaoka

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X-ray and optical study of ferroelastic phase transition in CsLiCrO₄ single crystal

K. S. Aleksandrov, A. I. Kruglik and S. V. Melnikova

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Ferroelectrics – superionics

V. K. Yanovskii and Y. I. Voronkova

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Crystal and magnetic structure of permanent magnet materials Nd₂Fe_14−xCo_xB

K. Girgis, M. Kraft, U. Weis, P. Fischer and M. Sostarich

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The magnetic structure of transition metal tetrametaphosphates

W. Gunsser, K. Rohwer and A. Weidenmann

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Magnetostriction in Zn_1−xCu_xCr₂Se₄, where 0.2 ≤ x ≤ 1.0

J. Kusz, S. Juszczyk and J. Warczewski

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Evolution of the dislocation structure of the high-purity deformed Mo single crystals during the softening process

L. N. Pronina and I. M. Aristova

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Effect of the initial preferred crystallites orientation on fracture mechanism in hexagonal metal. Anomalous failure behavior predicted by simple models based on neutron diffraction results

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Elastic constants of m-dinitrobenzene from diffuse reflection of X-rays

S. B. Sarkar and S. K. Talapatra

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Knoop hardness anisotropy of single crystals with hexagonal structure

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On the regularities of radiation-induced structure state formation in crystals with ion-covalent bonds

E. V. Kolontsova, V. P. Lutsenko, I. S. Pogosova, S. V. Red'ko and L. Ya. Karpov

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Order and disorder in Ca-stabilised zirconia: structural investigations up to 2000 K

G. Lorenz, R. Neder, H. Marxreiter, F. Frey, H. Schultz and H. Boysen

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The relationship between structure, hydroxy-apatite crystallite orientation and elastic properties of 12 000 years old Irish elk horn

J. L. Katz, B. Roger, P. Christel, L. Sedel and A. Meunier

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Calculation of atomic structure deformations in a stressed crystal

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Crystal structure of alkylthio-substituted tetrathiafulvalene as a 'molecular fastener'

Y. Higuchi, N. Yasuoka, G. Saito and H. Inokuchi

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The local triangular arrangements of Mn atoms in reentrant-spin-glass of Au-15 at.% Mn alloy

K. Ohshima and J. Harada

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Short-range ordering in ErRh₄B₄

J. L. Hodeau, M. Cornut and F. Lejay

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The crystal structures of UIr and UPt at 300 and 4 K

A. Dommann and F. Hulliger

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Anisotropy of the diamagnetic susceptibilities of diphenyl carbinol

S. A. Abdel-Hady

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Recent charge density studies

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Accurate structure factors from perfect crystals

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Determination of magnetisation densities in very weakly magnetic systems

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Coherent Compton scattering: a useful combination of position-space and momentum-space information

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Electron momentum spectroscopy of atoms and molecules – some recent results

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Atom size and charge in alkali halides

J. A. Henderson and E. N. Maslen

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Electron deformation density in alpha-boron

G. Will, B. Kiefer, B. Morosin and G. Slack

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Electron density distributions in GaP, GaAs and GaSb

R. Uno, K. Yukino, J. Ishigaki and H. Ozawa

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The electron density distribution in calcium-metaborate, Ca(BO₂)₂

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Extinction in the KMF₃ perovskites

N. Spadaccini and E. N. Maslen

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The influence of strong electric fields on the electron density distribution of molecular ions

J. van der Meulen and D. Feil

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Deformation electrostatic properties of L-alanine from single-crystal X-ray diffraction data at 23 K

R. Destro and R. E. Marsh

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Electron density distribution in cage-like compounds: directional preferences of electrophilic and nucleophilic attack

V. G. Puranik, S. S. Tavale and T. N. Guru Row

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Electron deformation density distribution in nonaaquaneodymium tris(trifluoromethanesulphonate)

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X–N charge density studies on bullvalene at 110 K

P. Luger, J. Buschmann, Th. Richter, R. K. McMullan, J. R. Ruble, P. Matias and G. A. Jeffrey

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Electron density distribution studies of compounds containing sulfur–sulfur bond

Y. Wang, C. H. Chen and J. H. Liao

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Structure/taste relationships of artificial sweeteners

R. Rudert, J. Buschmann, P. Luger, D. Gregson and G. Trummlitz

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X-ray analysis of wavefunctions by the least-squares method incorporating orthonormality

K. Tanaka and F. Marumo

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Molecular electron densities distribution from high-energy electron scattering by gases

S. Shibata, F. Hirota and K. Tachikawa

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Electron density in the alkali halide crystals in LDA (local density approximation)

G. Böbel, P. Cortona and F. G. Fumi

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Experimental and theoretical study of magnetical properties of chain silicates

S. Nagel, S. S. Hafner and H. Maghsudnia

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The third-order strain wave in antiferromagnetic chromium

J. Ihringer, K. Knorr, W. Kugler, J. Maichle, A. H. Millhouse, A. Petcov, W. Prandl and J. Reinhardt

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The band structure of silicon based on X-ray diffraction data

P. Sommer-Larsen and J. S. Avery

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Multipole analysis of charge density and physical properties: the alkaline earth oxides

G. Vidal-Valat, J.-P. Vidal, K. Kurki-Suonio and R. Kurki-Suonio

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Promoted states in the binding of transition metals

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Suberic acid charge density from X-ray and neutron diffraction

B. M. Craven, Q. Gao, H. P. Weber and R. K. McMullan

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Comparison of experimental and theoretical electrostatic potentials of carcinogenic nitrosomines

J. F. Noonan, R. Bar-Adon, L. I. Foss and E. D. Stevens

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The electron density distribution and crystal properties

R. P. Ozerov, V. G. Tsirelson, V. A. Streltsov and M. Kapphan

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Heterostructure and quantum well devices grown by molecular beam epitaxy

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Recent developments in the growth of epitaxal layers with metal-organic compounds

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High-resolution X-ray diffractometric, topographic and diffuse scattering characterization of defects in silicon crystals

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Structure–property correlations in organic and organometallic superconductors

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Crystal and electronic structures of organic superconductors based on multi-sulfur π-molecules

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Structural phase transitions in organic superconductors

R. Moret, S. Ravy and J. P. Pouget

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Polyhalogenides of BEDT-TTF and its derivatives: low-dimensional organic connectors

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Twinning in ferroic and nonferroic crystals

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Optical activity and phase transition

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Crystallography of the high critical temperature oxide superconductors

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Composition, structure and stability of YBa₂Cu₃O_x

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Surface-reconstructed structures studied by UHV-electron microscopy and diffraction

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Structure and optical properties of artificially ordered Ge–Si superlattices

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Crystal structure and the optical properties of dielectric crystals: a review

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Crystal structure and crystal optics

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The effect of microgravity on the growth of GaSb

L. Petras, I. Gyuro and E. Lendvay

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Influence of microgravity on crystallization front topography

D. Alamino and F. L. Falcon

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Nucleation potency of eutectic phases

V. V. Podolinsky, Yu. N. Taran and V. G. Drykin

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Crystal growth and destruction in the Cu–S system

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A new crystal growth form of vaterite CaCO₃

A. M. Shaikh and D. J. Shearman

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Surface morphology of melt-grown CdI₂ single crystals

S. Nigli, C. Jagadish and G. K. Chadha

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Crystal growth and superconductivity of Nb₃Sn, Nb₃Al, Nb₃Al_0.75Ge_0.25 and Nb₂Al

K. Christensen and S. E. Rasmussen

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Intergrowth in crystals of ZSM-5 zeolite

D. G. Hay, H. Jaeger and K. Wilshier

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Crystal growth by metastable nucleation

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On the orientation of K₂Cr₂O₇ crystals growing from aqueous solutions by self-nucleation on the crystallizer bottom

M. Szurgot and K. Sangwal

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Influence of temperature changes on sucrose crystal habit

S. Ameneiro, M. Wong and R. Pomes

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Dynamical observations of dendritic growth of aluminum–magnesium alloy single crystals by real time X-ray topography

T. Imura, T. Kobayashi and N. Kawabe

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Epitaxial growth of lead tin selenide films on (III) calcium fluoride and its characterization

M. Suzuki and T. Seki

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Diffraction studies of the interface between nickel films and sapphire substrates

C. J. Sparks, G. E. Ice and T. Habenschuss

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X-ray diffraction of Cu–Zn alloy films

Y. Wang, D. Su and S. Zwei

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Structural and electrical properties of laser-irradiated Pb_0.8Sn_0.2Te thin films

A. L. Dawar, C. Jagadish and P. C. Mathur

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The reproducibility of CuInSe₂ thin films by RF sputtering

T. Warminski, M. Kwietniak, R. Beaulieu and J. I. Loferski

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Crystallography of TiN_x films in excess of nitrogen

R. R. Manory and G. Kimmel

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Grazing incidence X-ray diffraction study of interfacial superstructure: a-Si on Ge_0.2Si_0.8 (111)-5×5

K. Akimoto, J. Mizuki, I. Hirosawa, T. Tatsumi, N. Aizaki and J. Matsui

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Several long-period crystal lattices formed by solid-state reaction in Bi–Mn double-layer films

K. Yoshida, Y. Taniguchi and T. Yamada

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Adsorption mechanism of thiol collectors on metal and sulfide surfaces

S. Anderson, K. Laajalehto, L.-S. Johansson and E. Suoninen

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Atomic displacement in hetero-interface regions of (GaAs)₂₈(AlAs)₂₄ superlattice layers

Y. Kashihara, T. Kase and J. Harada

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High-resolution study of rod-shape X-ray scattering from the (111) silicon surface

N. Kashiwagura, Y. Kashihara, M. Sakata and J. Harada

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Asymmetric X-ray diffraction method to the measurement of elastic constants for epitaxially grown single crystal

T. Tanaka, Y. Kashihara, J. Harada and N. Kashiwagura

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X-ray double-crystal diffraction study of homoepitaxial structures formed on porous silicon

Y. A. Labunov, V. P. Bondarenko, L. K. Glinenko and A. M. Dorofeev

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Theoretical approach to epitaxy of particles

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X-ray studies of artificial superlattices grown by molecular beam epitaxy

H. Terauchi, K. Kamigaki and H. Sakashita

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High-resolution UHV microscopy of gold atomic clusters

K. Takayanagi, Y. Tanishiro, K. Akiyama, K. Kobayashi and K. Yagi

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FIM investigations of orientation relations at the heat-treated B/W interfaces

A. Nakamura, S. Koike, M. Tagawa, N. Ohmae and M. Umeno

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An X-ray Fourier line shape analysis of hexagonal tellurium films: influences of substrates and temperatures

E. Chatterjee and S. P. Sen Gupta

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A high-resolution X-ray diffractometric and topographic study of electron–lattice interaction during two-dimensional conduction in silicon MOSFETs (klitzing elements)

K. Lal, P. Thoma, S. Niranjana, N. Goswami, V. Kumar, S. K. Halder and M. Thiemig

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X-ray diffraction analysis of diffusion in Mo/Si multilayers

O. B. Loopstra, Th. H. de Keijser, E. J. Mittemeijer and S. Radelaar

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X-ray double-crystal rocking curves and interface shape in III–V heterostructures

C. Bocchi, C. Ferrari and P. Franzosi

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Phase diagram of the tetragonal to orthorhombic structural transition in La_2−xSr_xCuO₄

R. Moret, J. P. Pouget, R. Comes and G. Collin

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High-resolution synchrotron X-ray study of La_2−xM_xCuO_4−y (M = Ba, Sr)

S. C. Moss, K. Forster, J. D. Axe, H. You, D. Hohlwein, D. E. Cox, P. H. Hor, R. L. Ming and C. W. Chu

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Neutron and synchrotron X-ray powder studies of a high ionic conductor system: Li_1+xTi_2−xIn_xP₃O₁₂

D. Tran Qui, S. Hamdoune, E. Prince and D. Cox

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X-ray and neutron powder diffraction studies of NASICON superion conductors

A. Clearfield, A. Moini, P. R. Rudolf and J. D. Jorgensen

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Modulated structure in a Bi₂O₃–Nb₂O₅ system

R. Miida, S. Suzuki and M. Tanaka

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Cation ordering, domains and conductivity in some hollandite ionic conductors

E. Fanchon, J. Vicat, J. L. Hodeau, J. P. Lévy and P. Wolfers

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Various types of ionic conductivity in RbNbWO₆ and TlNbWO₆ resulting from structure

V. A. Sarin, N. N. Bydanov, E. E. Rider, T. S. Chyornaya, L. A. Muradyan and V. I. Simonov

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Generalized Wigner crystal in quasi 1-D platinum chain compounds

A. Bertinotti and D. Luzet

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The tetrabutylammonium salt of dimerized bis(diselenolatoisotrithione)nickel(III), (TBA)₂[Ni(dsit)₂]₂

B. Morosin and P. J. Nigrey

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Electron microscopy and X-ray study of amorphous alloy Fe₄₀Ni₄₀B₂₀

J. A. Zaharidova and V. C. Anchev

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Hydrogen absorption by M₅X₃ phases

N. J. Clark and E. Wu

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Structure determination of potassium–benzene graphite intercalation compound (GIC)

H. Kurata, K. Ishizuka, T. Kobayashi and N. Uyeda

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A study of semiconductor intercalation in zeolite-Y using powder synchrotron X-ray diffraction

M. M. Eddy, G. D. Stucky, J. E. MacDougall, D. E. Cox and N. Herron

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New crystal chemistry, non-stoichiometric and glassy compounds in the As–V–O system

J. Galy, R. Enjalbert, J. M. Savariault and A. Medouar

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X-ray diffraction from thin epitaxial semiconductor layers and multiple quantum well structures

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On the effective electron mass in bismuth in the presence of a quantizing magnetic field

K. P. Ghatak, S. Bhattacharyya and S. Biswas

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Effect of an arbitrarily oriented quantizing magnetic field on the Einstein relation in n-channel inversion layers on ternary chalcopyrite semiconductors

S. Biswas, S. Bhattacharyya and K. P. Ghatak

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Section topographic study of semiconductor laser crystals

T. Tuomi, J. A. Lahtinen, H. Lipsanen, J. Partanen, E. Monberg and R. A. Logan

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X-ray diffraction study of a semi-conductor alloy AgIn_0.8Ga_0.2Te_1.6Se_0.4

K. Treechairusme and P. Phavanantha

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AEM study of CVD low-carbon boron carbide phases

K. L. Smith and I. D. R. Mackinnon

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Composition dependence of structural properties of flash-evaporated Cu_2−xIn_xSe₂ thin films

P. Kashyap, M. Jain, O. P. Agnihotri and H. K. Sehgal

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Properties of flash-evaporated epitaxial lead mercury chalcogenide film

M. Jain and H. K. Sehgal

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The structure of boron- and phosphorus-doped amorphous silicon thin films

D. R. McKenzie, D. J. B. Cockayne, Z. Liu, D. M. Dwarte and S. A. Song

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The orthorhombic/monoclinic symmetry change in single crystals of zeolite ZSM-5

H. van Koningsveld, H. van Bekkum and J. C. Jansen

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Synthesis and crystallographic data on a new silica zeolite, silica-ZSM-48

R. P. Gunawardane and H. Gies

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Hypothetical framework structures related to Mobil zeolite ZSM-48

J. L. Schlenker and W. J. Rohrbaugh

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A single-crystal structure of zeolite ZSM-39

J. Macicek, V. P. Vulchev and G. N. Kirov

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About crystal strucures of ZSM-11 and ZSM-39

A. Hardy, K. Ahmadi, P. Benjdir, A. Gravereau, J. L. Ouaili and J. L. Guth

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The effect of temperature and sorbents on the structures of zeolites ZSM-5, 11 and 39

G. T. Kokotailo, C. A. Fyfe, H. Strobl, G. J. Kennedy, G. C. Gobbi, C. T. Pasztor, G. E. Barlow and S. Bradley

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Structural studies of sodium zeolite X at high pressures

H. E. King Jr and J. M. Newsam

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Cesium vapor reduces all of the sodium ions in zeolite A. The excess cesium atoms sorbed can be baked out at 1000°C

N. H. Heo and K. Seff

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Structure of the nonstoichiometric solid solutions Ba₂RE₄[Ba_x+RE_2/3−2/3x]Ti₉O₂₇ (RE = Nd, Sm)

R. S. Roth, F. Beach, A. Santoro, K. Davis, J. L. Soubeyroux and M. Zucchi

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Structural precursors in the sol–gel processing of BaTiO₃

I. Gautier-Luneau, A. Mosset and J. Galy

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U₁₄Au₅₁, a new phase in the system U–Au

F. Hulliger and A. Dommann

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Report prepared for the microsymposium on the nomenclature of inorganic structure types

J. Lima-de-Faria, E. Hellner, E. Makovicky, F. Liebau and E. Parthé

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Schlegel projections and diagrams as a new tool to describe and understand solids

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Obtaining new structures from old

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Structural chemistry of hexaoxogermanates

W. Eysel, U. Lambert, S. Sussieck and B. Nuber

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A comparison of effective ionic cation radii of nitrides, sulfides and oxides

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The continuous transition from a tetragonal pyramidal to a trigonal bipyramidal Cu^IIO₅ coordination figure

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Rod-based sulphosalt structures

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The crystal structure of AgClO₄·H₂O and AgBF₄·H₂O

W. Ludwig and R. Wartchow

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The crystal structure of copper(I) sulfate Cu₂SO₄

H. J. Berthold and J. Born

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The crystal structure of a new cobalt oxide sulfate, Bi₂CoO₃SO₄

I. A. Fanariotis and P. J. Rentzeperis

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Crystal structures of seven cadmium selenites

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Structural chemistry of selenium(II) compounds: crystal and molecular structures of novel halogenoselenates(II)

B. Krebs, E. Lührs, L. Stork and R. Willmer

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Preparation and structures of inter-alkali metal chalcogenides

H. Sabrowsky, P. Vogt and A. Thimm

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Synthesis and crystal structure of a new non-centrosymmetric β-octamolybdate

P. Román, J. M. Gutiérrez-Zorrilla, M. Martínez-Ripoll and S. García-Blanco

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Structures of three sodium-calcium germanates

F. Nishi and Y. Takéuchi

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Non-periodic Patterson function of β-AgI

M. Tokonami, N. Haga, K. Koto and A. Yoshiasa

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Crystal structure determination of CaBa₂(B₃O₆)₂ by powder diffraction method

Q. Huang, Z. Zhou and J. Liang

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Interaction products of condensed phosphoric acids with various amines and amino acids

M. T. Averbuch-Pouchot and A. Durif

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The crystal structure of NH₄LaP₄O₁₂

J. Matuszewski and J. Kropiwnicka

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A refinement of K₃V₅O₁₄

T. Ozeki, H. Ichida and Y. Sasaki

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The crystal and molecular structure of [Cu(NH₃)₂(MoO₄)₂](NH₄)₂

J. A. Costamagna and J. L. Garin

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Structural studies on aluminate sodalites

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Synthesis, crystal structure, electron-microscopy analysis and magnetic properties of new β′′-alumina-like ferrites: (A,B)_1+xZn_xFe_11−xO₁₇ (x ~ 0.9) with A, B = Li, Na, K, Ag, Ca, Sr, Ba, Pb

H. Vincent, A. Bekka, M. Anne, J. C. Joubert and J. Gonzalez-Calbet

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Electron microscope and X-ray investigations on a (1.6) intergrowth tungsten bronze

H. B. Krause, S. Gollmar, R. Vincent and J. W. Steeds

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Short-range and long-range order models in anion-excess fluorite-related phases

J. P. Laval and B. Frit

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Two types of non-stoichiometric fluorite structures

N. N. Bydanov, L. A. Muradyan, B. A. Maximov, V. B. Alexandrov, B. P. Sobolev and V. I. Simonov

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Chemical bonding between closed shell atoms? Structural and physical properties of alkali metal mercury compounds

H. J. Deiseroth and A. Strunck

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X-ray, electron diffraction and HREM investigations of the metastable compound Au₄Si (m)

M. Ellner, E. Lukačević, W. Mader and K. Schubert

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Preparation and structural investigations of Mn₃As₂ and Mn₅As₄

H. Möller, L. H. Dietrich and W. Jeitschko

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An X-ray and neutron powder diffraction study of ternary gamma brass phases

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The structural classification of silicates

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Calcium sheet silicates: structural relationships and crystal chemistry

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An attempt of structure refinement of quartz

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Computational model of the structure and elastic properties of the high-pressure phases of MgSiO₃ (garnet, ilmenite and perovskite)

M. Matsui, M. Akaogi and T. Matsumoto

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The crystal structure of synthetic lipscombite: a redetermination

I. Vencato, E. Mattievich and Y. P. Mascarenhas

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OH=F substitution in the amblygonite–montebrasite series: a crystal structure and spectroscopic study

L. A. Groat, M. Raudsepp, F. C. Hawthorne, B. L. Sherriff and J. S. Hartman

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The incommensurately modulated structure of an andesine An₃₈

W. Steurer and H. Jagodzinski

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Polytypism in the hydrocalumite and related synthetic phases

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Crystal chemistry of europium in feldspars

S. Aslani-Samim, H. Binczycka, S. S. Hafner, H. Pentinghaus and K. Schurmann

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Structure determination and HRTEM investigation of a new pyrosmalite-group mineral

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Structural disorder and compositional order in aikinite and krupkaite

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Aluminium substitution in opal-A

J. A. Webb, B. L. Finlayson and T. R. Finlayson

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The structure of microcrystalline silica minerals

H. Graetsch, O. W. Flörke and G. Miehe

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More about the microstructure of opals

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Determination of the structure of lengenbachite by high-resolution TEM

T. B. Williams, A. Pring and B. G. Hyde

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The crystal structure of beudantite, PbFe₃·[(As,S)O₄]₂(OH)₆

J. T. Szymański

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Oriented transformation of azurite into tenorite

R. Guha and D. R. Dasgupta

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Application of transmission electron microscopy to the studies of transformation of minerals

N. Morimoto and M. Kitamura

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Kaolinite nucleation and macrocrystals growth while in suspended transport through quartz sandstone pore space

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Canasite: the refinement of crystal structure and comparison with that of miserite

I. V. Rozhdestvenskaya, L. V. Nikishova, I. I. Bannova and Yu. D. Lasebnik

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High-resolution electron microscopy study of tokkoite, a new mineral from Yakutia

L. V. Nikishova, I. P. Khaji, Yu. D. Lazebnik and A. L. Shirokov

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X-ray study of anthophyllite from schist in NE Iraq

M. M. Mahmoud, A. J. Al-Shakiry and Y. A. Kettaneh

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Crystal structure of two modifications of ζ-Mn₅Ge₂

T. Ohba, K. Kifune and Y. Komura

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The stereochemical versatility of chloro-mercury anions in crystallizing transition metal complexes

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Organotungsten complexes with oxygen and sulphur ligands

P. Legzdins, S. J. Rettig and J. Trotter

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Trends in transition metal carbyne chemistry

J. A. K. Howard, O. Johnson, F. Baumann, P. Sherwood, R. Musgrove and F. G. A. Stone

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Structural studies of carbido–carbonyl clusters in the cobalt subgroup

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Cluster framework structures for compounds within the M_x(Zr₆X₁₂Z)X_n family

R. P. Ziebarth and J. D. Corbett

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Structural patterns in polymetallic compounds with chalcogenides and derivatives

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Crystal structure and hydrogen bonding in a pentachlorothallium(III) compound

M. A. James, B. D. James and T. S. Cameron

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Molybdenum complexes of hydrazido- and diazenido-ligands derived from thio- and dithio-carbazates

R. Mattes, H. Scholand, U. Mikloweit and V. Schrenk

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Probing the mode of bonding in unsaturated silicon compounds: the structural criterion

J. Riede, G. Reber, G. Müller, K. Schurz, G. Wagner and N. Wiberg

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The question of bond fixation in fused benzene rings

R. Boese and D. Bläser

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To bridge or not to bridge: the formation of μ-oxo and hydroxo complexes by diphenyl tin carboxylates

N. W. Alcock and S. M. Roe

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An investigation of the torsional angles in the trifluoroacetate group

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X-ray studies on hydrogenated quinoline structure of 2-phenyl-3-methyl-4-hydroxylperhydroquinoline

M. Krishnaiah, L. Ramamurthy, K. Venkatesan and B. M. Gatehouse

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Crystal and molecular structure of 2-(α-phenylethyl)-3-methyl-3-carbonomethoxy-1-oxocyclohexane (C₁₇H₂₂O₃)

M. Vlassi and S. G. Biswas

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Crystal and molecular structure of (1aα,2β,2aβ,3α,3aα,4α,4aβ,5aβ,6α,6aα,7α,7aβ,8β,8aα)-tetradecahydro-2,8:4,6-dimethanoanthra[2,3-b:6,7-b′]bisoxirene-3,7-diol monohydrate C₁₆H₂₀O₄·H₂O

V. Ganesh, M. Seshasayee, R. Bakthavatchalam and S. R. Ramadas

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Crystal structure of tetramethylammonium dihydrogen orthophosphate monohydrate

N. Ohama, M. Machida, T. Nakamura and Y. Kunifuji

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On the change of the crystal structure caused by the chemical substitution at 4- or 4,4′-positions of trans-azobenzenes

S. Kashino, T. Yamashita and M. Haisa

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Crystal structure of HNS, 2,2′,4,4′,6,6′-hexanitrostilbene

F. Gerard and A. Hardy

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Crystal and molecular structure of 1-oxo-3-propoxyazepino[7,6-b]quinoxaline

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The crystal structures of two diazo oxides and a proposed bonding description

C. K. Lowe-Ma and W. S. Wilson

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Structures of macrocycles containing the 1,3,4-thiadiazole subunit

F. R. Fronczek, S. F. Watkins and S. Papparlardo

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Crystal structure of an asymmetric highly chlorinated diacetylene monomer, C₁₂H₄OCl₆

E. Molins, C. Miravitlles and J. Veciana

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Intramolecular S⋯O interactions in N,N′-dimethyl-2,2′-dithiodibenzamide and N-methyl-2-(benzylsulfinyl)benzamide

F. Iwasaki, N. Toyoda and N. Yamazaki

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Geometry studies of N-disubstituted 2,4-dinitroanilines. Effect of bulky substituents

G. Punte, B. E. Rivero, S. Socolovsky and N. S. Nudelman

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Crystal structure of ion-radical salts of several phenothiazine derivatives

T. Uchida and K. Kozawa

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Structure of some sesamin-type lignans

B. H. Eriksen and R. G. Hazell

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Resonance stabilization in alpha-furil

S. C. Biswas, S. Ray and A. Podder

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Crystal and molecular structure of mitoxantrone C₂₂H₂₄N₄O₆·2HCl·7H₂O

B. Ramakrishnan and M. A. Viswamitra

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Crystal and molecular structure of 5α-cholestane-3,6-dione

D. K. Sen and B. S. Basak

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Crystal and molecular structure of 10-methoxy-8,8-dimethyl-2H,8H-benzo(1,2-b:5,4-b)dipyron-2-one

A. K. Pal, R. Bandopadhyay, B. S. Basak, D. Heijdenrijk and K. Goubitz

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A comparative analysis of oxindole compounds

D. K. Chakraborty and S. K. Talapatra

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Analysis of rigid body motion of molecules in crystals

D. K. Chakraborty and S. K. Talapatra

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Crystal structure of 5-(4-ethylcyclohexyl)-2-(4-cyanophenylpyrimidine)

P. Mandal, B. Majumdar and S. Paul

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Crystal structure of (±)-8α-hydroxy-6α-methoxy-6β,8β-propano-5-benzo suberone-7β-acetic acid lactone, C₁₈H₂₀O₄

S. Hay and A. Seal

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Structural studies of sterically crowded molecules

T. W. Hambley, R. C. Cosmo and S. Sternhell

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Studies of nucleobases and their derivatives: crystal structures of 6-benzyl-2-thiouracil (C₁₁H₁₀N₂OS), 5-iodo-1-methyluracil (C₅H₅N₂O₂I)

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The structure of a resolved axially dissymmetric biaryl

F. W. B. Einstein, R. H. Jones and X. Songkai

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Structure of complexes of crown ethers with small organic molecules and ions

J. van Eerden and S. Harkema

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Crystal structure of 1,1-(α-cyano furan furfuryl acrylate) 2,2-dichloroethane

O. Durruthy, F. Fajardo and R. Pomes

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Tetraphenylantimony(V) compounds: structures of tetraphenylantimony(V) bromide, perchlorate, and tetraphenylborate

G. Ferguson, C. Glidewell, D. Lloyd and S. Metcalfe

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Structure of a heterobimetallic cobalt/platinum complex with unusual cobalt geometry

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Experimental modelling of the structure of cyclolinear carbosiloxanes

Yu. E. Ovchinnikov, V. E. Shklover and Yu. T. Struchkov

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Structure of bis(diphenylphosphino)ethylaminetricarbonyliron, Fe(CO)₃(C₆H₅)₂PN(C₂H₅)P(C₆H₅)₂

E. C. Horsfield, D. W. Engel and K. G. Moodley

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The structure of the low-temperature crystalline phase of Cu[O₂(CphOC₈H₁₇)₂CH₂], a compound which exhibits discotic mesomorphism at slightly elevated temperatures

E. M. Larson, P. G. Eller, B. Freiha, M. L. Horng and M. P. Eastman

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The neutron diffraction analysis of [(C₅Me₅)Ir(μ-H)₃Ir(C₅Me₅)]⁺[ClO₄]⁻·C₆H₆

R. Bau, R. C. Stevens, M. McLean and T. F. Koetzle

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Structures of three polymorphs of trans-[Pt(C₆H₉)H{P(C₆H₅)₃}₂]

K. D. Griffiths, G. B. Robertson and W. A. Wickramasinghe

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The crystal and molecular structure of calcium bipyridyl picrate

V. S. Yadava, V. M. Padmanabhan and N. S. Poonia

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Crystallographic studies of lithium halide complexes with aromatic amines

C. L. Raston, C. R. Whitaker and A. H. White

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Unusual silver(I) phenoxyalkanoates

G. Smith, C. H. L. Kennard, T. C. W. Mak, W.-H. Yip and E. J. O'Reilly

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Copper(I) and silver(I)-dirhodium polyhydrides

F. Bachechi, J. Ott, U. Statler and L. M. Venanzi

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Pyridine–base adducts of group (IB) metal(I) halides

L. M. Engelhardt, P. C. Healy, J. D. Kildea, B. W. Skelton and A. H. White

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Lewis base adducts of lead(II) iodide. Novel chain structures of lead(II) iodide with 2-pyrrolidone and ethyleneurea

H. Miyamae, M. Horiuchi, G. Hihara and M. Nagata

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Crystallography of complexes of thiourea and lead(II) salts. Crystal structures of PbBr₂·tu (I) and PbBr₂·2tu (II)

F. H. Herbstein, M. Kapon and G. M. Reisner

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The structures of complexes of mercury(II) halides with tetrahydroselenophene

C. Stålhandske

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Crystalline and molecular structure of (2-mercaptobenzoxalate) methylmercury(II) and (2-mercaptobenzoxolate) phenylmercury(II)

Y. P. Mascarenhas, K. Tomita, C. O. P. Santos and J. S. Casas

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Crystal structures of some dithiocarbamates

J. Garaj, V. Vrábel, E. Kellö and J. Lokaj

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Complexes of cadmium halides with 18-crown-6-ether

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f-Element/crown ether complexes. Structural effects of solvent and water of hydration hydrogen bonding

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f-Element/crown ether complexes. Crown conformations in hydrogen-bonded complexes of hydrated actinide salts

M. M. Benning and R. D. Rogers

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[Rh(MENOsar)]ZnCl₄·Cl·3H₂O and [Rh(MENOtar)]ZnCl₄·Cl·3H₂O: the effect of the size of the cavity of the encapsulating ligand on the metal–nitrogen bond lengths

R. J. Geue, M. B. McDonnell, A. M. Sargeson and A. C. Willis

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Organocobalt complexes with a buckled equatorial ligand

V. B. Pett, R. W. Jones, A. M. Mulichak, P. L. Choo, J. W. Bacon, D. E. Zacharias and J. P. Glusker

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Crystal structures of some complexes of lanthanides and amino acids

Y. Zheng and K. Pan

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Another amino acid copper complex. The crystal structure of bis-Cu(L-hydroxyproline)·4H₂O

M. T. L. Duarte, M. A. A. F. de C. T. Carrondo and M. B. Hursthouse

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Crystal structure of (L-prolinato)(2,2′-bipyridyl)palladium(II) chloride trihydrate

R. P. Patel and V. H. Padmanabhan

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The peculiarities of tripod ligands: coordination of semi- and thiosemicarbazidediacetic acid with vanadyl complexes

T. I. Malinovsky, I. F. Burshstein, N. V. Gerbeleu and O. A. Bologa

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Crystal structure of the sodium and chromium salts of diethyldithiophosphinate

G. Svensson and J. Albertsson

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X-ray and neutron diffraction studies of hexacyanometallates(III): crystal structures of Cs₂LiM(CN)₆ [M = Cr, Mn]

B. M. Chadwick, D. W. Jones, H. J. Wilde and J. Yerkess

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Crystal structure of binuclear hexaaquabis(ethylenediamine)-μ-pyromelitato-dinickel(II) tetrahydrate

D. Poleti, B. Prelesnik, R. Herak and Dj. Stojaković

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Crystal and molecular structure, magnetic and spectral properties of triaquabis(quinoxaline)copper(II) perchlorate

P. O. Lumme, S. Lindroos and E. Lindell

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The structure of complexes of Cu^II and Co^III with two- and threebasic aminoalcohols

T. I. Malinowsky, M. D. Mazus, Yu. A. Simonov, A. L. Kovalenko and V. N. Polyakov

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Crystal structure of bis(1,3-bis-(2-hydroxyphenyl)-1,3-propanedione)bis(dioxouranium(VI)) cobalt(II) hexakispyridine, C₅₀H₃₈N₄O₁₂U₂Co·2C₅H₅N

E. Molins, J. Rius, J. Colomer, F. Teixidor, C. Miravitlles and J. Casabó

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The first X-ray structurally characterized N-2-pyridinylcarbonyl-2-pyridinecarboximidate (BPCA) copper(II) complexes

J. V. Folgado, D. Beltrán, A. Fuertes and C. Miravitlles

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Crystal data and coordination number for some compounds

T.-H. Lu, C.-P. Cheng and C.-S. Chung

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Synthesis and physical properties of copper(II) coordination compounds with mesomorphic properties

M. Ghedini, R. Bartolino, G. Torquati, F. Rustichelli and N. Kirov

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A precision neutron study of the structure of tetraaquabis(hydrogen maleato)zinc(II)

A. Sequeira, H. Rajagopal and M. P. Gupta

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The stereochemistry of nitrosyl[tris(3,5-dimethylpyrazol)borate] complexes of molybdenum and tungsten

K. Paxton, C. D. Bush and T. A. Hamor

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Crystal structures of two technetium complexes containing oxalato ligands

S. F. Colmanet, M. F. Mackay and J. Baldas

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Structural chemistry of nitrido complexes of technetium

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Neodymium hexamethylphosphoramide (HMPA) complex with thiocyanate: a compound containing two different coordination polyhedra for two independent Nd^III ions

C. A. de Simone, E. E. Castellano, G. Vicentini and L. B. Zinner

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Tetrakisacetylacetonatothorium(IV), comparative results on structures in different crystal environments

J. H. Birkett and A. J. Smith

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Structure of a twinned crystal of Wolffram's red salt

S. Sato and K. Kobayashi

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Neutron diffraction study and refinement of structure based on combined X-ray and neutron data of dichloro(tetrapyridine)platinum(II) trihydrate, [Pt(C₅H₅N)₄]²⁺·2Cl⁻·3H₂O

C. H. Wei and W. R. Busing

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Characterization of supported olefin polymerization catalysts by X-ray diffraction

H. Österholm, P. Sormunen and B. Löfgren

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Crystal and molecular structures of a series of Fe–S cluster complexes (μ-R¹S)(μ-R²S)Fe₂(CO)₆

X. Yao, R. Wang, H. Wang, L. Song, Q. Hu and J. Wang

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Configuration and structural parameters of sulphur-containing iron carbonyl clusters formed via various thiones

G. J. Kruger, H. G. Raubenheimer and A. van A. Lombard

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Crystal and molecular structure of some cubane-like tetranuclear molybdenum clusters

J. L. Huang, J. Q. Huang, S. F. Lu, H. H. Zhang, D. M. Wu, Y. H. Lin, X. M. Zhang and J. X. Lu

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Structural–bonding analysis of several unusual molybdenum clusters: constrained refinements of disordered and thermally librating ligands

D. R. Tomchick, C. P. Gibson, K. J. Haller and L. F. Dahl

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Synthesis, X-ray structure and electrochemistry of [Pd₃(μ-CO)₂(C₅Me₅)₃][CF₃SO₃]

N. Boag, D. Boucher, J. A. Davies, A. A. Pinkerton and R. Syed

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Structural variations of bridged Re—Re bonds in some organometallic compounds

H.-J. Haupt, U. Flörke and H. Preut

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Thermal reaction of H₃Re₃(CO)₁₂ with P(C₆H₅)₃ and P(OC₆H₅)₃

L. K. Liu, S. C. Lin and C. P. Cheng

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The crystal and molecular structure of a novel gold–sulphido cluster compound

P. A. Bates and J. M. Waters

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Structures of high nuclearity clusters; fact and fiction

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Metal–metal bonding of the later transition metal ions in high oxidation states

D. Liaw, M. Tang, Y. Su and S. Peng

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Structural characterization of the monoclinic form of Ph₃PAuRh₃Ru(CO)₁₂ and its cubic form with Ru₃(CO)₁₂

J. Pursiainen, T. A. Pakkanen, M. Alghrén and J. Valkonen

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Lanthanoid carbide-halides – the borderline for metal–metal bonding

Hj. Mattausch, C. Schwarz and A. Simon

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Structures with oligomeric clusters in the indiumoxomolybdates: In₁₁Mo₄₀O₆₂, In₃Mo₁₁O₁₇

Hj. Mattausch and A. Simon

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Synthesis and crystal structures of several new ternary molybdenum oxides containing Mo–Mo bonding

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Crystal and molecular structure of N-alkylammonium heptamolybdates

P. Román, A. Luque, J. M. Gutiérrez-Zorrilla and A. Vegas

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A couple of crystal modifications of complex of mixed-valent cluster (VO₄³⁻)₂(VO²⁺)₃ and diethylenetriamine

Z. H. Pan, M. C. Shao, S. M. Xu and Y. Q. Tang

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New reduced oxoniobates containing Nb₆-clusters

J. Köhler and A. Simon

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V—O bond distances in structures of heteropolyvanadates

H. Ichida, T. Ozeki, K. Nagai, Y. Michiue and Y. Sasaki

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Whole-pattern structure refinement of crystalline fibrous polymers. The poly-isobutylene

P. Iannelli and A. Immirzi

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The crystal structure of some aliphatic polyesters

S. Deguire and F. Brisse

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Polymorphism in the fiber structure of poly-bis(4-4′-dicyclohexylmethane) n-dodecanediamide

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X-ray fiber diffraction analysis of some polysaccharide and nucleic acid structures

R. P. Millane, R. Chandrasekaran and S. Arnott

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Characterization of defects in X-ray topography using simulation methods

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Characterisation by X-ray topography of plastic deformation around indents on indium antimonide

M. R. Surowiec and B. K. Tanner

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Introduction: the significance of the Ewald's dynamical theory of diffraction

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The reciprocal lattice imbedded in Fourier space

D. W. J. Cruickshank

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Current status of phase determination by means of multiple Bragg scattering

Q. Shen and R. Colella

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X-ray standing wave applications in crystallography

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Perfect crystal optics for conditioning angle, energy, position and polarization of X-rays

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Recent developments and applications in perfect crystal optics

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Investigations of asymptotic-Bragg and kinematical scattering from ion-implanted and other silicon samples using an X-ray triple-axis diffractometer

S. W. Wilkins, A. W. Stevenson, J. Harada, N. Kashiwagura, S. Kimura, M. Sakata, T. Tanaka and K. Ohshima

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Sensitivity of X-ray dynamical reflecting power to the strain profile in heterostructures

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Surface X-ray diffraction

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Characterization of cubic boron nitride single crystals using X-ray topography and ion probe analysis technique

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Measurement of lattice parameter differences within a mixed-habit natural diamond by synchrotron double-crystal topography

A. R. Lang, G. Kowalski, A. P. W. Makepeace and M. Moore

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X-ray study of Brazil twins in natural amethyst

Z. Baran, K. Godwod and T. Warminski

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X-ray topographic study of dislocation formation at artificially introduced inclusions

M. Goebbels, R. A. Becker and H. Klapper

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Crystal defects induced by device manufacture of quartz oscillators

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XDT-observation of silicon single crystals irradiated with energetic heavy ions

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Lattice deformation of proton-implanted boundary in silicon

K. Biskupska, P. Naumowicz and K. Wieteska

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Investigation of helimagnetic domains in ZnCr₂Se₄ using neutron and synchrotron radiation topography

J. A. Cooper, J. Baruchel, M. Schlenker and S. B. Palmer

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Stroboscopic X-ray topography of quartz resonators

A. Zarka, B. Capelle, J. Detaint and J. Schwartzel

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The intensity distribution of X-ray wave field on the entrance surface in the Bragg case

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Plane defects in GaSe crystals

V. A. Goncharov, D. E. Batova, G. L. Belen'kii, Yu. A. Ossipyan and E. V. Suvorov

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The development of dislocation structure during bending of gallium phosphide

P. Paufler, O. Boehnke, K. Jurkschat and G. Wagner

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The comparison of X-ray and Raman measurements of strains in hydrogen-implanted gallium arsenide

E. Anastassakis, K. M. Biskupska, J. Tatarkiewicz and K. Wieteska

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An X-ray diffraction study of lattice imperfections in cold-worked face-centered-cubic alloys. VIII. Copper–silicon (α-phase)

S. K. Pradhan, M. De and S. P. Sen Gupta

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A γ-ray diffraction study of extinction in annealed silicon single crystals

J. R. Schneider, O. Gonçalves, H. A. Graf and W. Zulehner

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Comparison of mosaic spreads measured by three different experimental methods

L. P. Cardoso, C. Campos and S. Caticha-Ellis

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Annealing of Si after high-dose ³¹P⁺ implantation

L. Zsoldos, G. Pető, É. Zsoldos and G. Brogren

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Diffuse X-ray scattering from randomly twinned sphalerite crystals undergoing solid-state transformation to the wurtzite phase

M. T. Sebastian and P. Krishna

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High-resolution diffuse X-ray scattering study of defect structure in silicon single crystals by exploring reciprocal space around different lattice points with a four-crystal X-ray diffractometer

K. Lal and G. Bhagavannarayana

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A quantitative study of diffracted X-ray intensities from natural diamond crystals by using multicrystal X-ray diffractometers and comparison with silicon crystals

K. Lal, S. Niranjana, N. Goswami, V. Kumar, S. K. Halder and A. R. Verma

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The mechanism of polytype transformation in CdI₂ crystals

M. T. Sebastian and G. Mathew

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The mechanism of the 2H–3C solid-state transformation in silicon carbide

M. T. Sebastian, K. Narayanan and P. Krishna

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Inclusion-like defects in InP substrates and related defects in heteroepitaxial and Zn-diffused layers

P. Franzosi, G. Salviati, R. Audino and F. Taiariol

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Cracks in InP-based heterostructures

P. Franzosi, G. Salviati, F. Genova, S. Pellegrino and S. Stano

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Phason dispersion curves in tantalum disulphide by X-ray scattering

W. Minor, L. D. Chapman, S. N. Ehrlich and R. Colella

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Compilation of temperature factors of cubic materials

N. M. Butt, B. T. M. Willis, G. Heger and J. Bashir

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High-resolution X-ray scattering studies of defect-induced lattice distortions in SrTiO₃-type perovskites

R. J. Nelmes, P. D. Hatton, T. W. Ryan, U. J. Nicholls and H. Vass

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A monochromatic bond method using synchrotron radiation

S. Yasuami, K. Usuda, H. Kawata, Y. Higashi and M. Ando

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Diffuse neutron scattering on the niobium–deuterium system

J. C. Osborn and T. J. Hicks

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Animated simulation of the paths of the wave fields in a crystal containing a dislocation

Y. Epelboin, C. Guidi-Morosini, F. Morris, A. Rimsky and A. Soyer

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X-ray stationary waves in thin crystals

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Stationary waves from a single heterostructure on GaAs – a computer experiment

A. Authier, J. Gronkowski and C. Malgrange

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Self-consistency and conservation of energy in two-waves electromagnetic scattering

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Synchrotron X-ray wavelength tuning applied to Pendellösung and stacking fault fringe studies

A. R. Lang, G. Kowalski, A. P. W. Makepeace and M. Moore

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Accurate determination of the structure factors of alpha-quartz

K. Kobayashi, T. Takama and S. Sato

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Measurements of the X-ray Pendellösung beats from elastically bent silicon single crystals

T. Takama, K. Kobayashi and S. Sato

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The four-beam case: neutron measurements on α-quartz

H. Jagodzinski, N. Semioschkina, H. Boysen and F. Frey

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Temperature effect of X-ray diffraction intensities from a perfect crystal for the Laue case

Z. Sun, Z. Mai and P. Ge

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Bormann–Lehmann interference patterns – experiments and simulations

G. Kowalski and A. R. Lang

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Preliminary results of a novel technique for measuring anomalous scattering in single crystals

A. R. D. Rodrigues and I. Mazzaro

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Determination of the imaginary part of anomalous scattering factors for silicon

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Thermal phonons in the modified two-beam description of diffraction near a three-beam point

H. J. Juretschke

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Anomalous transmission of thermally scattered diffuse X-rays in a perfect germanium crystal

Y. Kashiwase, M. Mori, M. Kogiso, M. Minoura and S. Sasaki

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Experimental study on the diffraction optics of crystal Moiré

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Dynamical effects in grazing incidence diffraction of X-rays in Si

G. Wallner, N. Bernhardt, E. Burkel, G. Gompper, H. Metzger, J. Peisl and H. Wagner

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Dynamical diffraction of X-rays at grazing incidence

O. Sakata, H. Hashizume and I. Minato

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Experimental determination of triplet phases and enantiomorphs of non-centrosymmetric structures

K. Huemmer, H. Bondza and E. Weckert

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Determination of three-phase invariants from four-beam effects – use of effective structure factors

K. Marthinsen and R. Høier

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Physical estimation of X-ray triplet phases in mosaic crystals – current results and application in crystal-structure work

F. Mo and B. C. Hauback

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Direct observation of Bragg–Laue surface diffraction

C. Campos and N. L. Sanjurjo

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Observation of phase transition on K₂SnCl₆ single crystal by multiple diffraction of X-rays

C. Campos and M. M. F. d'Aguiar Neto

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Equations for diffuse scattering from disordered molecular crystals

R. Khanna and T. R. Welberry

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Evanescent absorption in kinematic surface diffraction

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Correction of X-ray intensities for multiple diffraction

B. C. Hauback and F. Mo

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Spin correlations in Au_0.85Fe_0.15

J. W. Cable, G. Parette and Y. Tsunoda

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Determination of the crystallite size distribution function for alkoxy-derived oxide materials

S. A. Ivanov, I. E. Obvintseva, M. I. Yanovskaya and Yu. N. Venevtsev

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The whole pattern database – a new concept for powder diffraction

D. K. Smith and G. G. Johnson Jr

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Recent advances in powder diffraction techniques with synchrotron radiation

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Optimization of powder diffraction geometry for conventional and synchrotron radiation sources

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The use of position-sensitive detectors in powder diffractrometry

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Problems in profile refinement of powder diffraction data

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New technologies in search–match procedures

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Use of the Rietveld method for determining component phase abundance and particle size/strain characteristics: applications to ceramics and batteries

R. J. Hill and C. J. Howard

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The application of neutron diffraction techniques to industry

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Powder diffraction based on synchrotron radiation X-ray source

T. Yamanaka, K. Ogata, K. Sugiyama and M. Tokonami

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Real-time neutron powder diffraction

J. Pannetier and A. W. Hewat

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Multi-scan X-ray diffractometry

R. A. Coyle and R. J. Pollard

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Application of profile fitting to a time-resolved study of the reduction of Fe₂O₃

S. J. Kipling and J. I. Langford

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The effect of crystallite size on powder pattern resolution and phase identification

D. K. Smith and H. D. Bennett

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A program for comparing and selecting of X-ray powder patterns of substances with similar structures

S. D. Kirik, S. A. Kovyazin and A. M. Fedotov

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NBS crystal data: compound identification by lattice matching using electron, X-ray or neutron diffraction data

V. L. Himes and A. D. Mighell

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The problem of computer identification of X-ray diffraction powder patterns

E. K. Vasil'ey and M. S. Nakhmanson

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The flux growth and crystallographic investigation of a new compound, Pb₃Bi_0.1Nb₂O_8.15, in the PbO–Bi₂O₃–Nb₂ O₅ system

S. Nie, D. Li, Z. Pu and Y. Xu

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Rietveld refinement of two substoichiometric vanadium nitrides

Ľ. Smrčok and P. Čapková

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Is it possible to determine a zeolite structure ab initio from synchrotron-quality powder diffraction data?

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Application of high-resolution synchrotron X-ray powder diffraction to the structure refinement of zeolite ZSM-11

B. B. Toby, M. M. Eddy, C. A. Fyfe, G. T. Kokotailo and D. E. Cox

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Structural changes on deactivation of ZSM-5 – a study by X-ray powder profile refinement

J. C. Taylor and D. M. Bibby

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X-ray Rietveld structure refinement of monoclinic ZSM-5

Ch. Baerlocher, P. Schicker and D. E. Cox

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Rietveld refinement and difference Fourier analysis of the todorokite structure using powder X-ray data

J. E. Post and D. L. Bish

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The structure determination of α-CrPO₄ and MnPO₄·H₂O by powder synchrotron X-ray diffraction

J. P. Attfield, A. K. Cheetham, P. Lightfoot and A. W. Sleight

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Application of X-ray whole powder-pattern fitting technique to the characterization of multicomponent ceramic materials

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Influence of particle size distribution on Rietveld profile analysis parameters for low-quartz

A. S. Zydek and B. H. O'Connor

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Combined refinement of synchrotron and neutron powder data from the superconductor BaPb_0.75Bi_0.25O₃

J. K. Maichle, J. P. Ihringer, W. Prandl, T. Wroblewski and A. W. Hewat

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Phase relationships in SYNROC

T. M. Sabine, W. Kalceff, F. Dickson and C. J. Ball

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The Rietveld method – an alternative approach

G. B. Mitra and P. Das Gupta

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The crystal structure of triclinic SF₆ from neutron powder diffraction measurements

B. M. Powell, M. T. Dove, G. S. Pawley and L. S. Bartell

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Rietveld analysis of powder patterns obtained by TOF neutron diffraction using cold neutron sources

F. Izumi, H. Asano and N. Watanabe

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Crystal structure determination of barium plutonate by neutron diffraction

A. C. Larson, G. G. Christoph, P. G. Eller, J. D. Purson, J. D. Zahrt, R. A. Penneman and G. H. Rinehart

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Profile-fitting procedures in the X-ray line-broadening analysis of polycrystalline materials

A. Benedetti, S. Enzo and G. Fagherazzi

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Numerical approximation to high-resolution time-of-flight neutron powder diffraction profiles

R. B. Von Dreele

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Difference methods in qualitative and quantitative powder diffraction analysis

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A new method to investigate textures: texture topography

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Crystallite size measurements by the Warren–Averbach technique

T. R. Finlayson, J. M. Long and R. J. Pollard

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Structures of the various phases of the 100 K superconductor Ba₂YCu₃O₇

J. J. Capponi, C. Chaillout, M. Marezio, A. W. Hewat, J. L. Soubeyroux, B. Raveau, N. Nguyen, P. Lejay, J. L. Tholence and R. Tournier

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Single-crystal pulsed neutron diffraction

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New ILL neutron single-crystal diffractometers: design and results

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Polarised neutron scattering by dynamic polarised targets

W. Knop, M. Krumpolc, K. H. Nierhaus, T. O. Niinikoski, V. Novotny, M. Rieubland, A. Rijllart, O. Schärpf, H.-J. Schink, H. B. Stuhrmann and R. Wagner

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Nuclear polarization and nuclear magnetic structure

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The correction of Bragg intensities for TDS

B. T. M. Willis

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Neutron and X-ray interferometer with separated crystals

U. Bonse and H. Uebbing

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The polarised target station at the 5 MW reactor of the GKSS research centre at Geesthacht

W. Knop, M. Krumpolc, K. H. Nierhaus, T. O. Niinikoski, V. Novotny, M. Rieubland, A. Rijllart, O. Schärpf, H.-J. Schink, H. B. Stuhrmann and R. Wagner

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Single-crystal neutron diffraction study on heavy and normal ice VI at 0.9 GPa

W. F. Kuhs, D. Londono, J. L. Finney and H. Ahsbahs

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D2B, a new very high resolution neutron powder diffractometer at ILL Grenoble

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Remarks on asymmetric Bragg reflection

W. Treimer and G. Hildebrandt

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A new isomorphous replacement method in small-angle neutron scattering

I. N. Serdyuk and M. Yu. Pavlov

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Small-angle neutron scattering studies on Brij-58 micelles

J. Schefer, R. McDaniels and B. P. Schoenborn

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SANS investigation of high-temperature precipitation in Al–Mg alloy

S. Abis, R. Coppola, D. Juul Jenson, M. Magnani and M. Stefanon

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On multiple small-angle scattering

S. Mazumder and A. Sequeira

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Texture analysis of three meteoritic samples by neutron diffraction

S. Höfler, G. Will and W. Schäfer

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Residual stress – a comparative study using neutrons, X-rays and finite element analysis

T. R. Finlayson, J. R. Griffiths, C. J. Howard and A. I. Johnston

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Characterization of grain boundaries and dislocations core structure by high-resolution electron microscopy

A. Bourret, J. Thibault and J. M. Penisson

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Defects at interfaces and surfaces studied by transmission electron microscopy

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Surface channeling in RHEED, REM and EELS

J. M. Cowley, L.-M. Peng and Z.-L. Wang

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Electron diffraction phenomena for very low energy electrons

D. F. Lynch and A. E. Smith

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Surface structure analysis of Si(111) 7×7-H by RHEED

S. Mizuno, A. Ichimiya, T. Fujii and K. Yamauchi

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Exploiting dynamical high-energy electron diffraction effects

C. J. Humphreys and D. J. Eaglesham

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Image deconvolution for perfect crystal images

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Simulating an electron image at high resolution

D. Van Dyck and W. Coene

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Structure determination of aperiodic objects by high-resolution electron microscopy

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Bloch wave degeneracies and non-systematic critical effects in convergent-beam electron diffraction

J. Gjønnes and H. Matsuhata

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Space-group determination of osmium disilicide by convergent-beam electron diffraction

A. W. S. Johnson and F. J. Lincoln

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Dynamical diffraction calculations for RHEED and REM

L.-M. Peng and J. M. Cowley

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Structure determination by electron scattering

A. F. Moodie and H. J. Whitfield

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The application of the multislice method to the calculation of convergent-beam RHEED patterns

A. E. Smith and D. F. Lynch

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Geometries and large-amplitude motions of molecules studied by a combined analysis of gas electron diffraction, spectroscopy and ab initio calculation

T. Egawa, Y. Ohshima, K. Yamanouchi, S. Yamamoto, M. Nakata, Y. Hamada and K. Kuchitsu

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Structure refinement from HREM images using direct difference methods

P. Goodman, S. Rae and P. Tulloch

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HREM image processing applied to GaAs/AlAs interfaces

A. F. de Jong and W. Coene

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Structural analyses of metastable phases in Li₂O–TiO₂ system by ED and HREM

J. Zou, F. H. Li, D. Y. Yang, Y. D. Jiang and K. H. Kuo

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Observation of structures of vacuum co-deposited Bi–Mn films by high-resolution electron microscopy

T. Yamada and K. Yoshida

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New structures of alkali niobium tungsten oxides derived by HREM and X-ray powder diffraction

M. Lundberg and M. Sundberg

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On the structure of Pr₂₄O₄₄: a study by high-resolution electron microscopy

E. Schweda, D. J. Smith and L. Eyring

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Electron beam induced modifications in potassium β′′′-ferrite (K₂O·4FeO·15Fe₂O₃

J. L. Hutchison, F. J. Lincoln and Y. Matsui

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Structural studies to atomic resolution of inorganic crystals and quasicrystals by electron microscopy and crystallographic image processing

D. N. Wang and S. Hovmöller

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A study of cation ordering in spinels by convergent-beam electron diffraction and imaging

A. F. Moodie and H. J. Whitfield

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Crystal structure determination of blatterite using analytical electron microscopy

A. Olsen and G. Raade

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Image simulations and image processing of HREM images of metal-loaded zeolites

H. W. Zandbergen, W. Coene and D. van Dyck

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Multi-slice computation on a personal computer

D. F. Lynch and L. C. Qin

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Image formation using STEM electron microdiffraction patterns stored on video tape

J. Konnert, P. D'Antonio and J. M. Cowley

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Obtaining atomic coordinates from electron microdiffraction patterns

J. Konnert and P. D'Antonio

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Boundary structure analysis of layered lattice – modification of CSL model

Y. Kitano, M. Takata and Y. Komura

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Formation of lattice superperiods in polycrystalline SiC

L. U. J. T. Ogbuji

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High-resolution electron microscopy and microdiffraction of MgO–metal composite films

N. Tanaka and K. Mihama

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Systematic HRTEM imaging of tetrahedral semiconductors

R. W. Glaisher, D. J. Smith and A. E. C. Spargo

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Dynamical diffraction effect on high-resolution electron microscopy of alloys with imperfect order

D. Shindo, K. Hiraga and M. Hirabayashi

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Following Molière's theory with synchrotron radiation

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X-ray birefringence, anomalous scattering and the phase problem

D. H. Templeton and L. K. Templeton

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Polycrystalline diffraction and synchrotron radiation

W. Parrish and M. Hart

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Ultra-SAS with point-focusing geometry using synchrotron radiation

U. Bonse, R. Pahl and R. Nußhardt

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Bragg reflection X-ray optics for synchrotron radiation sources

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Microcrystal diffraction techniques

J. M. Newsam and H. E. King Jr

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Quasi real-time study of (adiabatic) dislocation creation in synthetic quartz near the α–β phase transition temperature (T_c) using white synchrotron radiation (WSR)

J. D. Stephenson

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Hitachi beam line at KEK for EXAFS studies

A. Nakano, O. Abe and T. Edamura

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K edge X-ray absorption spectroscopic investigations on selected iron compounds with synchrotron radiation

G. Henkel, B. Krebs, H.-F. Nolting, P. Eggers, C. Hermes, R. F. Pettifer and D. L. Foulis

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Synchrotron studies of solid-state transformations involving amorphous phases

J. B. Parise, A. W. Sleight, D. R. Corbin, H. S. Horowitz, M. A. Subramanian, T. Egami and W. Dmowski

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Near-edge fine structure of low-Z elements by inelastic scattering of 5–20 keV synchrotron X-rays

W. Schülke and H. Nagasawa

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RDF study of Ge–As–Se glass employing anomalous scattering

A. Nukui, Y. Shimizugawa, H. Morikawa and Y. Hasegawa

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The interference fringe due to X-ray resonant scattering

M. Yoshizawa, T. Kawamura, K. Ehara, T. Nakajima, H. Suguwara, T. Fukamachi and K. Hayakawa

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Atomic positions of K-shell electrons observed by SR X-ray anomalous scattering

S. Sasaki and K. Tsukimura

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Profile analysis on the basis of the energy-dispersive spectra at high pressure and temperature using synchrotron radiation

T. Yamanaka and K. Ogata

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High-pressure X-ray diffraction measurements on potassium nitrate using synchrotron radiation

D. M. Adams, P. D. Hatton, A. E. Heath and A. Norman

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Observations of martensitic transformation and some behaviours of lattice imperfections in helium-4 crystals by SR X-ray topography

H. Suzuki, T. Nakajima and I. Iwasa

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Experimental results of triplet phase determination using synchrotron radiation

E. Weckert, H. Bondza and K. Huemmer

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Inelastic X-ray scattering from phonons

E. Burkel, Th. Illini, J. Peisl and R. Dorner

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An X-ray multiple diffraction study of GaAs and GaAs–AlAs superlattice by SR

M. Sakata, O. Kishibe and S. Sasaki

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X-ray diffraction studies using synchrotron radiation at Daresbury Laboratory

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Crystallographic applications of synchrotron radiation at the National Synchrotron Light Source crystallography station X-13B

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Single-crystal diffractometer data

T. A. Hamor, H. Steinfink and B. T. M. Willis

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Microstructure in high-temperature superconductors of perovskite type observed in high-resolution electron microscopy and in situ convergent-beam diffraction

A. F. Moodie and H. J. Whitfield

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The delta-diffractometer – a new type of four-circle diffractometer

H. Burzlaff, J. Lange and W. Rothammel

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A special X-ray device for structural investigations under extreme conditions

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A multi-purpose γ-ray diffractometer

J.-E. Jørgensen

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High-speed high-accuracy Bragg spacing measurements

M. Hart and D. Häusermann

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New method for indexing Laue patterns

K. Ohsumi, K. Miyahara and M. Ohmasa

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Single-crystal energy-dispersive Laue-type experiments

K. F. Fischer and H.-G. Krane

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A new type of a focusing X-ray monochromator for synchrotron radiation

P. U. Pennartz, K. Kosten, Th. Hinsch and H. Arnold

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QUID, Queensland University Inclinational Diffractometer, a low-cost computer-controlled data collection system

N. J. Carlos and C. H. L. Kennard

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Least-squares determination of sample centering and instrument errors for four-circle diffractometers

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New program system for four-circle diffractometer

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NRCCAD, an enhanced CAD-4 diffractometer control program

P. S. White, Y. Le Page and E. J. Gabe

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Revised software for routine data collections of twinned crystals with the Siemens AED2

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Computer simulation of two-dimensional intensity distributions obtained with crystal-monochromated X-radiation and a small specimen crystal

A. W. Stevenson

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Generalization of the classical 'parallel' condition

A. McL. Mathieson

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Design and performance of imaging-plate system for X-ray diffraction study

Y. Amemiya, A. Nakagawa, T. Matsushita, Y. Satow, J. Chikawa, S. Miura and J. Miyahara

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Small-molecule data collection with a Nicolet (Xentronics) area detector

K. J. Haller and R. A. Sparks

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Image processing of diffraction patterns involving sharp and/or diffuse scattering

H. J. Milledge, M. J. Mendelssohn and P. A. Woods

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Impact of the CDROM on the use of the Powder Diffraction File

R. Jenkins, M. Hojomany and R. Anderson

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X-ray diffractometry of low-mass samples

L. S. Zevin and I. M. Zevin

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High-resolution X-ray powder diffractometer

M. Ahtee and P. Suortti

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Time-resolved powder diffraction of reactions using laboratory, synchrotron and neutron sources

P. Barnes, S. M. Clark, S. E. Tarling, E. Polak, G. Mamott and J. Anwar

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Application of the crystallographic investigation of urine in clinical practice

V. G. Maidannik, V. D. Chebotareva and V. G. Burlai

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Goniometric device and liquid helium cyrostat for single-crystal studies with X-ray four-circle diffractometer down to 7 K

J. Muller, R. Argoud, J. J. Capponi and M. Marezio

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X-ray diffractometer for structure investigation of surfaces

D. Dornisch, F. Kretschmar, H. Schulz, U. Tangermann and D. Wolf

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APOCALYPSE now: update on automated protein crystallization using the new ACA vapor diffusion plate

N. D. Jones, J. K. Swartzendruber, J. B. Deeter, P. W. Landis and D. K. Clawson

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Automated procedure for handling anomalous dispersion corrections in the general case for white or characteristic radiation data

M. J. Mendelssohn and H. J. Milledge

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Automated labyrinth coupling and safety shutter operation for side-entry collimators and Philips tube shield

G. B. Robertson and L. Smith

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Problems in space-group assignments

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Errors in absolute-structure determination

G. Bernardinelli and H. D. Flack

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Analysis and use of crystallographic data

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Overview of direct methods, with anomalous dispersion

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Optimal symbolic addition

H. Schenk and R. Peschar

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Maximum entropy and the foundations of direct methods

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Direct methods outside traditional field

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Future methodology, some probables and some possibles

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The role of statistics in structure refinement

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The effects of weighting schemes on estimated standard deviations and on accuracy

B. E. Robertson

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The Bayesian viewpoint of statistical procedures in crystallography

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Report on the work of the Subcommittee on Statistical Descriptors

D. Schwarzenbach

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Simultaneous search for symmetry-related molecules in Patterson space

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ROTSEARCH – a Patterson search program for positioning randomly oriented molecular fragments

J. Rius and C. Miravitlles

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On combining probabilistic two-phase structure invariants with Harker construction

D. Guo and H. Hauptman

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MULTAN87

T. Debaerdemaeker, C. Tate and M. M. Woolfson

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Phase determination of structure-factor triplets and quartets using high-order multiple diffraction of X-rays

S.-L. Chang, H.-H. Huang, S.-W. Luh, H.-P. Pan, M. T. Tang and J. M. Sasaki

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A pseudo-random starting set tendencially maximally entropical

M. C. Burla, G. Cascarano, C. Giacovazzo, A. Nunzi and G. Polidori

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A reconsideration of the role of two-phase semi-invariants

M. C. Burla, G. Cascarano, C. Giacovazzo, A. Nunzi and G. Polidori

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Investigation of phase invariants from a power series expansion of the entropy functional

I. R. Castleden

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Direct methods solutions from very weak data

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The use of E-magnitude weighting schemes in convergence mapping and tangent refinement in direct methods

S. R. Brown and C. J. Gilmore

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The use of maximum entropy in the a priori phasing of small molecules

G. Bricogne and C. J. Gilmore

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Ab initio phase determination using the consistent electron-density method

T. N. Bhat and H. L. Ammon

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The solution of crystal structures with pseudo-symmetry by SIMPEL

R. A. J. Driessen and H. Schenk

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The phasing of SAS data via direct methods

S. Fortier and M. E. Fraser

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Phasing single isomorphous replacement data with direct methods

M. E. Fraser, S. Fortier and N. J. Moore

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The effects of pseudotranslations on reciprocal space

R. Böhme and W. Gebert

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Maximum entropy electron density estimation

J. Navaza, C. de Rango and G. Tsoucaris

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Origin-defining restraints in polar space groups

H. D. Flack and D. Schwarzenbach

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Modern optimization techniques in structure least-squares refinement combined with distance restrictions

R. Krüsemann, W. Hoffmann and H. Kroll

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The use of a window function to refine partially overlapped twin data

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Maximum likelihood determination of parameters for powder, Laue and divergent beam patterns

E. Ratajczyk and W. A. Keller

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A rational dependence screening test

J. S. Rutherford

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Space groups rare for organic compounds

A. J. C. Wilson

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Cauchy distribution, intensity statistics and phases of reflections from crystal planes

G. B. Mitra and S. Das

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Effect of inaccessible volumes accompanied by symmetry elements on cumulative distribution functions

D. Pradhan and G. D. Nigam

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Practical resolution of the centrosymmetric–noncentrosymmetric ambiguity with the use of E-statistics

M. R. Snow and E. R. T. Tiekink

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Identification of merohedrical twins of structures showing superstructure effects

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Effects of symmetry and atomic heterogeneity on cumulative distribution function – some hypersymmetric situations

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Factor analysis of the cholesterol side-chain conformation

W. L. Duax, Z. Wawrzak, J. Griffin and C. Cheer

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A statistical analysis of structural precision from crystallographic data

F. H. Allen and M. J. Doyle

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Crystallographic microcomputing

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Desktop crystallography – the next generation of computers

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The macromolecular workbench

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Computer graphics techniques for exploring molecular structures and properties

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Computer graphics in the synthesis, analysis and communication of biomolecular structural information

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ENDIX – a computer program to simulate energy dispersive X-ray and synchrotron powder diffraction diagrams

E. Hovestreydt, E. Parthé and U. Benedict

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MISSYM, a program for the derivation of the symmetry elements implied in a structure description

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A flexible procedure for the elimination of manual re-input of crystal structure data

K. Osaki, T. Taga and N. Yasuoka

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NRCVAX – an interactive crystal structure system

E. J. Gabe, Y. Le Page, P. S. White and F. L. Lee

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Extension of the Xtal system of crystallographic software for protein crystallographic applications

K. D. Watenpaugh, D. R. Holland and J. M. Stewart

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Rietveld method runs on IBM-AT

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A microprocessor version of the Xtal system

S. Hall, L. Engelhardt and T. Schmah

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Visualization and fast energy calculation of protein–ligand interaction on 3D display

A. Itai, N. Tomioka and Y. Iitaka

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Artificial intelligence in conformational analysis

A. R. Leach, D. P. Dolata and C. K. Prout

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Inorganic graphics for microcomputers

B. O. Loopstra, R. A. J. Driessen and H. Schenk

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Molecular analogues of surface complexes and modelization of metal–support interaction: X-ray structure of (μ-H)(μ-OSiEt₃)Os₃(CO)₁₀, computer modeled surface structures (μ-H)(μ-OSi )Os₃(CO)₁₀ and (μ-OSi )₂Os₃(CO)₁₀

L.-Y. Hsu, S. Shore, L. D'Ornelas, A. Choplin and J.-M. Basset

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Proposal from the subcommittee of the Commission on Journals with the charge of developing a uniform nomenclature for those parameters that are operationally related to or measure the influence of temperature on scattering

H. Hope, M. B. Hursthouse and S. E. Rasmussen

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Status of Volume A

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Status of Volume B

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Status of Volume C

A. J. C. Wilson

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Status of photocomposition direct from author-prepared disk or tape

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Experiments with electronic transmission of scientific text

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Do we need a Volume D?

A. J. C. Wilson

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Crystallographic publishing: rewards and challenges

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Future trends with Acta

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Trends in the Journal of Applied Crystallography

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Centralised checking of manuscripts

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The need to standardize structures to recognize structural relationships

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Handling of crystallographic information now and in the future

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Teaching crystallography using computer graphics

T. Sakurai, K. Kobayashi, T. Horiki, K. Naitou and M. Furukawa

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Teaching aids for crystallography

C. H. L. Kennard

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Some programs for microcomputers

H. Schenk, R. A. J. Driessen, B. O. Loopstra, P. Molhoek, W. J. Urban and M. Zoutberg

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Dichroic and trichroic symmetry of diamond clan designs in the aboriginal bark paintings from N. E. Arnhem Land, Australia

E. Makovicky and H. Morphy

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Symmetry and quasicrystals

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The crystallographic relevance of quasicrystals

A. Janner and T. Janssen

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Electron microscopy evidences of quasiperiodicity

M. Hirabayashi and K. Hiraga

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About quasiperiodic diffraction spectra

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Quasicrystalline and related crystalline structures

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On the Hermann–Mauguin symbols

H. Wondratschek

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Symmetry elements and symmetry operations

J. D. H. Donnay

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Present and future activities of the ad hoc Committee on Nomenclature of Symmetry

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NMR studies of incommensurate phases

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Soft phonon modes and the diffraction of incommensurate structures

J. M. Pérez-Mato

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An overview of neutron scattering studies of incommensurate phases

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Origin of incommensurate behavior in insulators: the principle of latent symmetry

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Division of space into polyhedra with all vertices symmetrically related. Geometrical and colored symmetry considered

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Symmetry conditions for 3-periodic minimal balance surfaces

E. Koch and W. Fischer

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The application of eigensymmetries of face forms to X-ray diffraction problems

H. Klapper and Th. Hahn

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The non-characteristic orbits of the plane groups

T. Matsumoto and H. Wondratschek

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Lattice sites and NMR chemical shifts in silicon carbide polytypes

M. F. Richardson, J. S. Hartman, B. L. Sherriff and B. G. Winsborrow

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Study of substitutional solid solutions in melt-grown crystals of cadmium iodide

U. P. Tyagi and G. C. Trigunayat

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Effect of doping on the polytypism and electrical conductivity of CdBr₂ single crystals

S. Nigli, C. Jagadish and G. K. Chadha

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Electron microscopic evidence for 'discommensurations' and metal atom trimer formation in the pseudo one-dimensional compounds MTe₄ (M = Nb, Ta)

J. Mahy, J. Van Landuyt and S. Amelinckx

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Modulated phases in the Ca₂SiO₄–Ba₂SiO₄ system

R. L. Withers, J. G. Thompson and B. G. Hyde

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Geometrical models of fluorite-related superstructures as aids to structure determination. The structure of Ca₂YbF₇

D. J. M. Bevan, S. E. Lawton, M. J. McCall, M. R. Taylor and H. J. Rossell

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X-ray analysis of metallic superlattices with single-crystal techniques

R. H. M. van de Leur, J. te Nijenhuis and F. Tuinstra

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Cu₂GeS₃: a monoclinic member of the sphalerite group

G. S. D. King and H. Goethals

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Determination of defect structure in γ-MnO₂

N. Yamada and M. Ohmasa

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Crystal structure and morphology of the incommensurately modulated compound AuTe₂, calaverite

W. J. Schutte, B. Dam, A. Janner and J. L. de Boer

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Electron diffraction patterns displaying 8-, 10- and 12-fold symmetries but no Bravais translation symmetry

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Electron diffraction study of icosahedral quasicrystals of an Al₇₄Mn₂₀Si₆ alloy

M. Tanaka, M. Terauchi, K. Hiraga and M. Hirabayashi

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Defects in Al–Mn–Si icosahedral quasicrystals studied by high-resolution electron microscopy

K. Hiraga and M. Hirabayashi

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Icosahedral symmetry and diffraction experiment

V. S. Shekhtman and E. V. Shulakov

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Incommensurate phases and invar effect

V. Sh. Shekhtman, T. K. Barsamian and S. S. Khasanov

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Static and dynamic structure of quasicrystals and other incommensurate crystal phases

R. Currat and T. Janssen

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Disorder, average structure and subgroups

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Structural studies on CC-1065/DNA interactions

D. C. Rohrer, T. A. Scahill and W. C. Krueger

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Chromium incorporation into mullite

H. Rager and H. Schneider

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Molecular packing in mesogenic crystals

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X-ray diffraction study of cholesterol–cholesteryl oleate binary mixtures

B. Dubini, P. Mariani, M. G. Ponzi-Bossi, F. Rustichelli and S. Melone

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X-ray diffraction and optical studies of oriented liquid crystal (BBBA)

P. Mandal, M. Mitra, S. Paul and R. Paul

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Lyotropic cubic phases

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A relation between X-ray found liquid structure and packing coefficient

A. Mikusińska-Planner

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High-resolution electron microscopy of semiamorphous materials

B. K. Moss, J. D. McLean, P. Goodman and R. W. Truss

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Calculation of small-angle scattering from model structures for surfactant systems

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On the interpretation of small-angle X-ray scattering from microemulsions

T. R. Welberry and T. N. Zemb

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Effects of drying on the fractal structure of gels of silica

A. F. Craievich, D. I. dos Santos, M. Aegerter, T. Lours and J. Zarzycki

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A generalized crystallography

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P. P. Ewald in his German period

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Paul P. Ewald – an appreciation

H. J. Juretschke

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Structures of engineered dihydrofolate reductase

J. E. Villafranca, E. E. Howell, S. J. Oatley, M. S. Warren, C. David, J. Hirai and J. Kraut

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Interpretation of momentum densities

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Molecular graphics on microcomputers

G. M. Sheldrick

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Advances

Recently published Advances articles are given below.

Interpretation of angular symmetries in electron nanodiffraction patterns from thin amorphous specimens. A. C. Y. Liu, G. R. Lumpkin, T. C. Petersen, J. Etheridge & L. Bourgeois (2015). Acta Cryst. A71, doi:10.1107/S2053273315011845.

Identification of inversion domains in KTiOPO₄ via resonant X-ray diffraction. F. Fabrizi, P. A. Thomas, G. Nisbet & S. P. Collins (2015). Acta Cryst. A71, 361-367.

Partial order among the 14 Bravais types of lattices: basics and applications. H. Grimmer (2015). Acta Cryst. A71, 143-149.

SHELXT - Integrated space-group and crystal-structure determination. G. M. Sheldrick (2015). Acta Cryst. A71, 3-8.

Special issues

Mathematical Crystallography

Bragg centennial issue

Laue centennial issue

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