most read articles

These are the most read articles in the last six months.

The seventh blind test of crystal structure prediction: structure generation methods. L. M. Hunnisett, J. Nyman, N. Francia, N. S. Abraham, C. S. Adjiman, S. Aitipamula, T. Alkhidir, M. Almehairbi, A. Anelli, D. M. Anstine, J. E. Anthony, J. E. Arnold, F. Bahrami, M. A. Bellucci, R. M. Bhardwaj, I. Bier, J. A. Bis, A. D. Boese, D. H. Bowskill, J. Bramley, J. G. Brandenburg, D. E. Braun, P. W. V. Butler, J. Cadden, S. Carino, E. J. Chan, C. Chang, B. Cheng, S. M. Clarke, S. J. Coles, R. I. Cooper, R. Couch, R. Cuadrado, T. Darden, G. M. Day, H. Dietrich, Y. Ding, A. DiPasquale, B. Dhokale, B. P. van Eijck, M. R. J. Elsegood, D. Firaha, W. Fu, K. Fukuzawa, J. Glover, H. Goto, C. Greenwell, R. Guo, J. Harter, J. Helfferich, D. W. M. Hofmann, J. Hoja, J. Hone, R. Hong, G. Hutchison, Y. Ikabata, O. Isayev, O. Ishaque, V. Jain, Y. Jin, A. Jing, E. R. Johnson, I. Jones, K. V. J. Jose, E. A. Kabova, A. Keates, P. F. Kelly, D. Khakimov, S. Konstantinopoulos, L. N. Kuleshova, H. Li, X. Lin, A. List, C. Liu, Y. M. Liu, Z. Liu, Z.-P. Liu, J. W. Lubach, N. Marom, A. A. Maryewski, H. Matsui, A. Mattei, R. A. Mayo, J. W. Melkumov, S. Mohamed, Z. Momenzadeh Abardeh, H. S. Muddana, N. Nakayama, K. S. Nayal, M. A. Neumann, R. Nikhar, S. Obata, D. O'Connor, A. R. Oganov, K. Okuwaki, A. Otero-de-la-Roza, C. C. Pantelides, S. Parkin, C. J. Pickard, L. Pilia, T. Pivina, R. Podeszwa, A. J. A. Price, L. S. Price, S. L. Price, M. R. Probert, A. Pulido, G. R. Ramteke, A. U. Rehman, S. M. Reutzel-Edens, J. Rogal, M. J. Ross, A. F. Rumson, G. Sadiq, Z. M. Saeed, A. Salimi, M. Salvalaglio, L. Sanders de Almada, K. Sasikumar, S. Sekharan, C. Shang, K. Shankland, K. Shinohara, B. Shi, X. Shi, A. G. Skillman, H. Song, N. Strasser, J. van de Streek, I. J. Sugden, G. Sun, K. Szalewicz, B. I. Tan, L. Tan, F. Tarczynski, C. R. Taylor, A. Tkatchenko, R. Tom, M. E. Tuckerman, Y. Utsumi, L. Vogt-Maranto, J. Weatherston, L. J. Wilkinson, R. D. Willacy, L. Wojtas, G. R. Woollam, Z. Yang, E. Yonemochi, X. Yue, Q. Zeng, Y. Zhang, T. Zhou, Y. Zhou, R. Zubatyuk & J. C. Cole (2024). Acta Cryst. B80, 517-547.

The seventh blind test of crystal structure prediction: structure ranking methods. L. M. Hunnisett, N. Francia, J. Nyman, N. S. Abraham, S. Aitipamula, T. Alkhidir, M. Almehairbi, A. Anelli, D. M. Anstine, J. E. Anthony, J. E. Arnold, F. Bahrami, M. A. Bellucci, G. J. O. Beran, R. M. Bhardwaj, R. Bianco, J. A. Bis, A. D. Boese, J. Bramley, D. E. Braun, P. W. V. Butler, J. Cadden, S. Carino, C. Červinka, E. J. Chan, C. Chang, S. M. Clarke, S. J. Coles, C. J. Cook, R. I. Cooper, T. Darden, G. M. Day, W. Deng, H. Dietrich, A. DiPasquale, B. Dhokale, B. P. van Eijck, M. R. J. Elsegood, D. Firaha, W. Fu, K. Fukuzawa, N. Galanakis, H. Goto, C. Greenwell, R. Guo, J. Harter, J. Helfferich, J. Hoja, J. Hone, R. Hong, M. Hušák, Y. Ikabata, O. Isayev, O. Ishaque, V. Jain, Y. Jin, A. Jing, E. R. Johnson, I. Jones, K. V. J. Jose, E. A. Kabova, A. Keates, P. F. Kelly, J. Klimeš, V. Kostková, H. Li, X. Lin, A. List, C. Liu, Y. M. Liu, Z. Liu, I. Lončarić, J. W. Lubach, J. Ludík, N. Marom, H. Matsui, A. Mattei, R. A. Mayo, J. W. Melkumov, B. Mladineo, S. Mohamed, Z. Momenzadeh Abardeh, H. S. Muddana, N. Nakayama, K. S. Nayal, M. A. Neumann, R. Nikhar, S. Obata, D. O'Connor, A. R. Oganov, K. Okuwaki, A. Otero-de-la-Roza, S. Parkin, A. Parunov, R. Podeszwa, A. J. A. Price, L. S. Price, S. L. Price, M. R. Probert, A. Pulido, G. R. Ramteke, A. U. Rehman, S. M. Reutzel-Edens, J. Rogal, M. J. Ross, A. F. Rumson, G. Sadiq, Z. M. Saeed, A. Salimi, K. Sasikumar, S. Sekharan, K. Shankland, B. Shi, X. Shi, K. Shinohara, A. G. Skillman, H. Song, N. Strasser, J. van de Streek, I. J. Sugden, G. Sun, K. Szalewicz, L. Tan, K. Tang, F. Tarczynski, C. R. Taylor, A. Tkatchenko, R. Tom, P. Touš, M. E. Tuckerman, P. A. Unzueta, Y. Utsumi, L. Vogt-Maranto, J. Weatherston, L. J. Wilkinson, R. D. Willacy, L. Wojtas, G. R. Woollam, Y. Yang, Z. Yang, E. Yonemochi, X. Yue, Q. Zeng, T. Zhou, Y. Zhou, R. Zubatyuk & J. C. Cole (2024). Acta Cryst. B80, 548-574.

Current developments and trends in quantum crystallography. A. Krawczuk & A. Genoni (2024). Acta Cryst. B80, 249-274.

New ion radii for oxides and oxysalts, fluorides, chlorides and nitrides. F. C. Hawthorne & O. C. Gagné (2024). Acta Cryst. B80, 326-339.

Tailoring the dimensionality of metal complexes via ligand modifications. P. Le Garff, R. Maria Losus, S. Chaudhary & L. Dobrzańska (2024). Acta Cryst. B80, 19-26.

Computation screening for incorrectly determined cocrystal structures. S. Chalupná, M. Hušák, J. Čejka, F. Fňukal & J. Klimeš (2025). Acta Cryst. B81, 208-216.

The chemical theory of valence. I. D. Brown (2025). Acta Cryst. B81, 164-167.

Modulation of the modulated magnetic structure of an Ho i-MAX phase described by a magnetic (3+2)-dimensional superspace group. C. V. Colin, Q. Tao, C. Opagiste, R. Balou, J. Rosen, T. Ouisse & V. Petříček (2025). Acta Cryst. B81, 37-46.

Intrusion of quantum crystallography into classical lands. S. Yu & J.-M. Gillet (2025). Acta Cryst. B81, 168-180.

Polymorph sampling with coupling to extended variables: enhanced sampling of polymorph energy landscapes and free energy perturbation of polymorph ensembles. E. J. Chan & M. E. Tuckerman (2024). Acta Cryst. B80, 575-594.

Polymorphism of Pb₅(PO₄)₃OH_δ within the LK-99 mixture. M. Xu, H. Wang, C. Vojvodin, J. R. Yarava, T. Wang & W. Xie (2024). Acta Cryst. B80, 746-750.

SARAh – web representational analysis. A. S. Wills (2025). Acta Cryst. B81, 28-36.

Electric charge and salting in/out effects on glucagon's dipole moments and polarizabilities using the GruPol database. R. F. Ligorio, R. H. M. Gehle, L. H. R. Dos Santos & A. Krawczuk (2025). Acta Cryst. B81, 192-201.

Crystal structure and compressibility of magnesium chloride heptahydrate found under high pressure. K. Yamashita, K. Komatsu, T. Hattori, S. Machida & H. Kagi (2024). Acta Cryst. B80, 695-705.

Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe³⁺-doped single-crystal samples. P. Ballirano, B. Celata, A. Pacella, A. Bloise & F. Bosi (2025). Acta Cryst. B81, 84-91.

K_0.72Na_1.71Ca_5.79Si₆O₁₉ – the first oligosilicate based on [Si₆O₁₉]-hexamers and its stability compared to cyclosilicates. V. Kahlenberg, H. Krüger, S. Garber, B. Krüger, E. Libowitzky, S. Kröll, T. S. Hofer, J. M. Gallmetzer & F. R. S. Purtscher (2024). Acta Cryst. B80, 474-487.

Importance of powder diffraction raw data archival in a curated database for materials science applications. S. Kabekkodu & T. Blanton (2024). Acta Cryst. B80, 364-369.

On the magnetic and crystal structures of NiO and MnO. V. Pomjakushin (2024). Acta Cryst. B80, 385-392.

Analysis of magnetic structures in JANA2020. M. S. Henriques, V. Petříček, S. Goswami & M. Dušek (2024). Acta Cryst. B80, 409-423.

Accurate and efficient representation of intramolecular energy in ab initio generation of crystal structures. Part III: partitioning into torsional groups. I. J. Sugden, D. H. Bowskill, B. I. Tan, Y. Zhang, C. S. Adjiman & C. C. Pantelides (2025). Acta Cryst. B81, 114-127.

Magnetic crystallography comes of age. C. P. Brock & A. M. Glazer (2024). Acta Cryst. B80, 509-513.

The seventh blind test highlights exciting developments in crystal structure prediction. M. Arhangelskis (2024). Acta Cryst. B80, 514-516.

Assessment of the exchange-hole dipole moment dispersion correction for the energy ranking stage of the seventh crystal structure prediction blind test. R. A. Mayo, A. J. A. Price, A. Otero-de-la-Roza & E. R. Johnson (2024). Acta Cryst. B80, 595-605.

Following the guidelines for communicating commensurate magnetic structures: real case examples. F. Damay (2024). Acta Cryst. B80, 235-248.

Magnetic space groups versus representation analysis in the investigation of magnetic structures: the happy end of a strained relationship. J. Rodriguez-Carvajal & J. M. Perez-Mato (2024). Acta Cryst. B80, 370-376.

Symmetry, magnetic transitions and multiferroic properties of B-site-ordered A₂MnB′O₆ perovskites (B′ = [Co, Ni]). J. L. Garcia-Muñoz, X. Zhang, G. Subías & J. Blasco (2024). Acta Cryst. B80, 665-675.

Is it possible to obtain a plausible experimental electronic structure without collecting high-order diffraction data?. A. Hlinčík, L. Bučinský, M. Breza & J. Kožíšek (2025). Acta Cryst. B81, 217-224.

Selective acceleration and inhibition of crystal growth of glass carbamazepine by low-concentration poly(ethylene oxide):effects of drug polymorph. C. Tian, Q. Zhang, J. Xu & Q. Shi (2025). Acta Cryst. B81, 55-61.

Structural and magnetic phase transitions in Eu_1–xLa_xFe₃(BO₃)₄ (x = 0, 0.18). E. S. Smirnova, K. V. Frolov, E. V. Sidorova, T. A. Sorokin, O. A. Alekseeva, A. V. Guskov, P. G. Gagarin & I. A. Gudim (2025). Acta Cryst. B81, 69-83.

Crystal structures of two new high-pressure oxynitrides with composition SnGe₄N₄O₄, from single-crystal electron diffraction. P. Gollé-Leidreiter, S. Bhat, L. Wiehl, Q. Wen, P. Kroll, R. Ishikawa, M. Etter, R. Farla, Y. Ikuhara, R. Riedel & U. Kolb (2024). Acta Cryst. B80, 182-192.

Structural and magnetic properties of β-Li₂IrO₃ after grazing-angle focused ion beam thinning. N. Hua, F. Breitner, A. Jesche, S.-W. Huang, C. Rüegg & P. Gegenwart (2025). Acta Cryst. B81, 202-207.

The incommensurate composite Y_xOs₄B₄ (x = 1.161). B. Stöger, O. Sologub & L. Salamakha (2024). Acta Cryst. B80, 724-731.

A rare case of Na/Zn isomorphism in the crystal structure of non-centrosymmetric zincophosphate Na₅Zn[Zn(PO₄)₃]. O. V. Yakubovich, G. V. Kiriukhina, A. S. Volkov & O. V. Dimitrova (2025). Acta Cryst. B81, 62-68.

Synthesis and characterization of an organic–inorganic hybrid crystal: 2[Co(en)₃](V₄O₁₃)·4H₂O. E. S. Vosegaard, M. A. H. Mamakhel, V. S. Parmar, A. D. Bertelsen & B. B. Iversen (2024). Acta Cryst. B80, 488-494.

New insights into the magnetism and magnetic structure of LuCrO₃ perovskite. A. Muñoz, J. Gainza, J.-S. Zhou, J. L. Martinez, E. Céspedes, M. T. Fernández-Díaz & J. A. Alonso (2024). Acta Cryst. B80, 377-384.

A comprehensive characterization of thiophosgene in the solid state. F. Tambornino, S. Ringelband, S. F. Parker, C. M. Howard & D. Fortes (2024). Acta Cryst. B80, 495-503.

Supramolecular architectures in multicomponent crystals of imidazole-based drugs and trithiocyanuric acid. A. Ben, M. Hoelm & L. Chęcińska (2024). Acta Cryst. B80, 294-304.

Hydrogen bonding patterns and C—Hπ interactions in the structure of the antiparkinsonian drug (R)-rasagiline mesylate determined using laboratory and synchrotron X-ray powder diffraction data. A. J. Dugarte-Dugarte, R. A. Toro, J. van de Streek, J. A. Henao, A. N. Fitch, C. Dejoie, J. M. Delgado & G. Díaz de Delgado (2023). Acta Cryst. B79, 462-472.

Lattice response to the radiation damage of molecular crystals: radiation-induced versus thermal expansivity. C. J. McMonagle, C. A. Fuller, E. Hupf, L. A. Malaspina, S. Grabowsky & D. Chernyshov (2024). Acta Cryst. B80, 13-18.

Seed layer formation by deposition of microcrystallites on a revolving substrate: modeling of the effective linear elastic, piezoelectric, and dielectric coefficients. A. Ballato & J. Ballato (2024). Acta Cryst. B80, 760-765.

High-throughput nanoscale crystallization of dihydropyridine active pharmaceutical ingredients. J. P. Metherall, P. A. Corner, J. F. McCabe, M. J. Hall & M. R. Probert (2024). Acta Cryst. B80, 4-12.

Photoelasticity of crystals with the scheelite structure: quantum mechanical calculations. N. M. Demyanyshyn, B. G. Mytsyk, A. S. Andrushchak & A. V. Kityk (2025). Acta Cryst. B81, 47-54.

Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. G. Pavlović, E. Lekšić & E. Meštrović (2024). Acta Cryst. B80, 193-200.

Crystal structure solution and high-temperature thermal expansion in NaZr₂(PO₄)₃-type materials. B. S. Hulbert, J. E. Brodecki & W. M. Kriven (2024). Acta Cryst. B80, 146-159.

Synthesis and properties of Sr₂La₂NiW₂O₁₂, a new S = 1 triangular lattice magnet. A. Smerechuk, A. Guilherme Buzanich, B. Büchner, S. Wurmehl & R. Morrow (2024). Acta Cryst. B80, 467-473.

Structural insight into the cooperativity of spin crossover compounds. H. Shahed, N. Sharma, M. Angst, J. Voigt, J. Perßon, P. Prakash, K. W. Törnroos, D. Chernyshov, H. Gildenast, M. Ohl, G. Saffarini, A. Grzechnik & K. Friese (2023). Acta Cryst. B79, 354-367.

Review of honeycomb-based Kitaev materials with zigzag magnetic ordering. V. O. Garlea & C. L. Sarkis (2025). Acta Cryst. B81, 11-27.

Computational analysis tools for magnetic structures in the Bilbao Crystallographic Server. E. S. Tasci, L. Elcoro, J. M. Perez-Mato, G. de la Flor, G. Madariaga & M. I. Aroyo (2025). Acta Cryst. B81, 181-191.

A short note on the use of irreducible representations for tilted octahedra in perovskites. A. M. Glazer (2024). Acta Cryst. B80, 362-363.

Crystallization induced by fungi and bacteria. O. Frank-Kamenetskaya & D. Vlasov (2025). Acta Cryst. B81, 1-10.

Search for missing symmetry in the Inorganic Crystal Structure Database (ICSD). M. Avdeev (2024). Acta Cryst. B80, 451-455.

3D electron diffraction analysis of a novel, mechanochemically synthesized supramolecular organic framework based on tetrakis-4-(4-pyridyl)phenylmethane. D. Marchetti, A. Pedrini, C. Massera, M. F. Faye Diouf, C. Jandl, G. Steinfeld & M. Gemmi (2023). Acta Cryst. B79, 432-436.

Structural and theoretical studies of amantadinium fenamates. M. S. Krawczyk, M. K. Krawczyk & I. Majerz (2025). Acta Cryst. B81, 92-103.

Solvatomorphism in a series of copper(II) complexes with the 5-phenylimidazole/perchlorate system as ligands. E. Loukopoulos, C. Papatriantafyllopoulou, E. Moushi, A. A. Kitos, A. J. Tasiopoulos, S. P. Perlepes & V. Nastopoulos (2024). Acta Cryst. B80, 347-359.

Cs₄Ca[Si₈O₁₉]: a new mixed tetrahedral–octahedral oxosilicate, its topological features and comparison with other interrupted framework silicates. V. Kahlenberg (2025). Acta Cryst. B81, https://doi.org/10.1107/S2052520625002537.

Determining magnetic structures in GSAS-II using the Bilbao Crystallographic Server tool k-SUBGROUPSMAG. R. B. Von Dreele & L. Elcoro (2024). Acta Cryst. B80, 424-429.

Comparative study of conventional and synchrotron X-ray electron densities on molecular crystals. E. S. Vosegaard, J. V. Ahlburg, L. Krause & B. B. Iversen (2023). Acta Cryst. B79, 380-391.

The varying temperature- and pressure-induced phase transition pathways in hybrid improper ferroelectric Sr₃Sn₂O₇. E. Ladbrook, J. P. Tidey, F.-T. Huang, S.-W. Cheong, D. Daisenberger, M. R. Warren & M. S. Senn (2025). Acta Cryst. B81, https://doi.org/10.1107/S2052520625002306.

Quantitative crystal structure analysis in trifluoromethyl- and cyano-substituted N-phenylbenzamides. K. Mandal & D. Chopra (2025). Acta Cryst. B81, 266-282.

Strain distribution in GaN/AlN superlattices grown on AlN/sapphire templates: comparison of X-ray diffraction and photoluminescence studies. A. Wierzbicka, A. Kaminska, K. Sobczak, D. Jankowski, K. Koronski, P. Strak, M. Sobanska & Z. R. Zytkiewicz (2025). Acta Cryst. B81, 283-289.

Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl₆] under high pressure. E. B. Rusanov, M. D. Wörle, M. V. Kovalenko, K. V. Domasevitch & J. A. Rusanova (2024). Acta Cryst. B80, 135-145.

Magnetic structure determination of multiple phases in the multiferroic candidate GdCrO₃. P. Manuel, D. Khalyavin, F. Orlandi, L. Chapon, W. Xueyun, T.-H. Jang, E. S. Choi & S.-W. Cheong (2025). Acta Cryst. B81, https://doi.org/10.1107/S2052520625001921.

A new crystal phase of calcium stannate CaSn₂O₄(OH)₂ and its physico-chemical properties. T. V. Bogdan, Y. D. Ivakin, V. V. Chernyshev, N. V. Mashchenko, A. E. Koklin, E. V. Tararushkin, T. V. Fedoseev, M. A. Skiba & V. I. Bogdan (2025). Acta Cryst. B81, 225-234.

Crystallography of the litharge to massicot phase transformation from neutron powder diffraction data. R. J. Hill & L. M. D. Cranswick (2025). Acta Cryst. B81, 146-160.

From `crystallographic accuracy' to `thermodynamic accuracy': a redetermination of the crystal structure of calcium atorvastatin trihydrate (Lipitor^®). J. van de Streek, D. Firaha, J. A. Kaduk & T. N. Blanton (2024). Acta Cryst. B80, 682-687.

Pushing crystallography's frontiers through quantum mechanics. C. F. Matta (2025). Acta Cryst. B81, 161-163.

A fresh view on the structure and twinning of owyheeite, a rod-polytype and twofold superstructure. B. Stöger, C. Göb & D. Topa (2023). Acta Cryst. B79, 271-280.

The structure of magnesium stearate trihydrate determined from a micrometre-sized single crystal using a microfocused synchrotron X-ray beam. M. Herzberg, T. Rekis, A. Støttrup Larsen, A. Gonzalez, J. Rantanen & A. Østergaard Madsen (2023). Acta Cryst. B79, 330-335.

Study on the vertical Bridgman method of melt-grown CsPbBr₃ single crystals for nuclear radiation detection. M. Zhang, C. Huang, G. Xia, J. Liu, F. Tian, J. Zou & B. Tang (2024). Acta Cryst. B80, 64-71.

Incommensurate magnetic structure of CrAs at low temperatures and high pressures. A. Eich, A. Grzechnik, Y. Su, B. Ouladdiaf, D. Sheptyakov, T. Wolf, V. Petricek, H. Shahed & K. Friese (2023). Acta Cryst. B79, 473-481.

Three-dimensional electron diffraction on clinkers: the belite α′_H incommensurate modulated structure. S. Plana-Ruiz, E. Götz, T. Neumann, P. Schwesig & U. Kolb (2024). Acta Cryst. B80, 105-116.

Crystal structure predictions for molecules with soft degrees of freedom using intermonomer force fields derived from first principles. R. Nikhar, R. Podeszwa, A. U. Rehman, O. Ishaque, A. Jing, J. W. Melkumov, R. Hong & K. Szalewicz (2024). Acta Cryst. B80, 628-655.

Disorder- and magnetism-driven structural changes in Sm₂Mn_1–xGa_6–yGe_y. R. A. Khalaniya, A. V. Mironov, A. Kulchu, O. Khrykina & A. V. Shevelkov (2025). Acta Cryst. B81, 235-243.

Electron density and elastic properties of crystalline [Co(NH₃)₅NO₂]ClNO₃: a quantum crystallography study. M. Khainovsky, E. Terekhova, E. Boldyreva & V. Tsirelson (2025). Acta Cryst. B81, 244-255.

Elastic and inelastic strain in submicron-thick ZnO epilayers grown on r-sapphire substrates by metal–organic vapour phase deposition. M. C. Martinez-Tomas, O. Klymov, K. Shimazoe, J. F. Sánchez-Royo, M. E. Changarath, S. Agouram & V. Muñoz-Sanjosé (2024). Acta Cryst. B80, 72-83.

Analytical description of nanowires. III. Regular cross sections for Wurtzite structures. Corrigendum. D. König & S. C. Smith (2025). Acta Cryst. B81, 290.

Spin reorientation and the interplay of magnetic sublattices in Er₂CuMnMn₄O₁₂. J. M. Attah-Baah, D. D. Khalyavin, P. Manuel, N. S. Ferreira, A. A. Belik & R. D. Johnson (2024). Acta Cryst. B80, 656-664.

Crystal structure of nickel orthovanadate (Ni₃V₂O₈) at 299 (3) K and 1323 (8) K: an X-ray diffraction study. F. Aziz, W. Paszkowicz, R. Minikayev, C. Martin, M. Kozlowski & H. Teisseyre (2024). Acta Cryst. B80, 715-723.

As predicted and more: modulated channel occupation in YZn_5+x. R. T. Fredrickson & D. C. Fredrickson (2023). Acta Cryst. B79, 320-329.

Radiation damage as a source of information. E. V. Boldyreva (2024). Acta Cryst. B80, 1-3.

Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb_nBi₄Te₄S_n+2. J. Yao, C. L. Ciobanu, N. J. Cook & K. Ehrig (2023). Acta Cryst. B79, 482-494.

Contrasting conformational behaviors of molecules XXXI and XXXII in the seventh blind test of crystal structure prediction. G. J. O. Beran, C. J. Cook & P. A. Unzueta (2024). Acta Cryst. B80, 606-619.

Looking at high-pressure electrides through the lens of quantum crystallography: the case of simple cubic calcium. S. Racioppi & E. Zurek (2025). Acta Cryst. B81, 256-265.

High-pressure and low-temperature behaviour of organic ferroelectric (R)-3-quinuclidinol. S. S. Sharaya, N. E. Bogdanov, B. A. Zakharov & E. V. Boldyreva (2025). Acta Cryst. B81, 104-113.

Structural studies of hydrated rare earth nitrates within the stereoatomic model of crystal structures. A. V. Savchenkov & G. M. Kuz'micheva (2025). Acta Cryst. B81, 128-134.

Morphological control for hollow rod crystals of a photochromic diarylethene on spherulites by surface properties of substrates. M. Isobe, D. Kitagawa & S. Kobatake (2024). Acta Cryst. B80, 732-737.

Synthesis and structural study of the partially disordered complex hexagonal phase δ₁-MnZn_9.7. A. Mondal, R. Pan, S. K. Kuila, R. Dey & P. P. Jana (2024). Acta Cryst. B80, 688-694.

Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. M. Moya, G. R. Liendo-Polanco, R. Atencio, P. Silva, J. A. Henao & J. Bruno-Colmenares (2024). Acta Cryst. B80, 782-792.

Atypical phase transition, twinning and ferroelastic domain structure in bis(ethylenediammonium) tetrabromozincate(II) bromide, [NH₃(CH₂)₂NH₃]₂[ZnBr₄]Br₂. Z. Czapla, M. K. Krawczyk & V. Kinzhybalo (2024). Acta Cryst. B80, 738-745.

Electron traps and energy storage: modeling a bright path to the future. R. T. Moura Jr (2023). Acta Cryst. B79, 430-431.

Synthesis and structural characterization of a new dinuclear platinum(III) complex, [Pt₂Cl₄(NH₃)₂{μ-HN=C(O)Bu^t}₂], and Synthesis and structure of two novel trans-platinum complexes. Addenda and errata. IUCr Editorial Office (2024). Acta Cryst. B80, 360.

Conformational disorder in quercetin dihydrate revealed from ultrahigh-resolution synchrotron diffraction. Y. Bibila Mayaya Bisseyou, J. Wright & C. Jelsch (2024). Acta Cryst. B80, 766-781.

Predicting co-crystal structures of N-halide phthalimides with 3,5-dimethylpyridine. Z. Momenzadeh Abardeh, F. Bahrami & A. R. Oganov (2024). Acta Cryst. B80, 620-627.

Variable stoichiometry and a salt–cocrystal intermediate in multicomponent systems of flucytosine: structural elucidation and their impact on stability. M. Kanagavel, S. Balasubramanian & S. K. Nechipadappu (2024). Acta Cryst. B80, 793-806.

Electron density distribution in bis(guanidinium) disodium hypodiphosphate heptahydrate, (CH₆N₃)₂Na₂(P₂O₆)·7H₂O. P. Starynowicz, K. A. Ślepokura, P. Kurowska & V. Kinzhybalo (2025). Acta Cryst. B81, 135-145.

A contribution to the crystal chemistry and topology of organic thiosulfates: bis(1-methylpiperazinium)·S₂O₃·H₂O versus 1-methylpiperazinediium·S₂O₃·3H₂O. D. O. Charkin, A. M. Banaru, S. A. Ivanov, V. E. Kireev & S. M. Aksenov (2024). Acta Cryst. B80, 706-714.

Crystal structure of the incommensurate modulated high-pressure phase of the potassium guaninate monohydrate. A. A. Gaydamaka & S. V. Rashchenko (2024). Acta Cryst. B80, 676-681.

A new Section Editor for Acta Cryst. B. L. N. Dawe & A. Nangia (2024). Acta Cryst. B80, 361.

Density functional theory investigation of the phase transition, elastic and thermal characteristics for AuMTe₂(M = Ga, In) chalcopyrite compounds. N. Boucerredj, F. Semari, S. Ghemid, H. Oughaddou, R. Khenata, A. Bouhemadou, M. Boucharef, H. Meradji, Z. Chouahda, S. Bin-Omran & S. Goumri-Said (2024). Acta Cryst. B80, 807-820.

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