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. (2024). Acta Cryst. B80, 517-547.
The seventh blind test of crystal structure prediction: structure ranking methods. (2024). Acta Cryst. B80, 548-574.
CRYSP: construction and visualization of crystal shapes in natural habits and on planar substrates. (2026). Acta Cryst. B82, 14-21.
Importance of powder diffraction raw data archival in a curated database for materials science applications. (2024). Acta Cryst. B80, 364-369.
The varying temperature- and pressure-induced phase transition pathways in hybrid improper ferroelectric Sr3Sn2O7. (2025). Acta Cryst. B81, 318-324.
Structure and properties of (Nd,Sr)(Al,Ta)O3 (NSAT) substrate crystals. (2026). Acta Cryst. B82, 131-142.
Modulation of the modulated magnetic structure of an Ho i-MAX phase described by a magnetic (3+2)-dimensional superspace group. (2025). Acta Cryst. B81, 37-46.
OD (order–disorder) interpretation and diffuse scattering analysis of an organic polytype with allotwin character: a detailed how-to. (2025). Acta Cryst. B81, 550-564.
Crystal structure and compressibility of magnesium chloride heptahydrate found under high pressure. (2024). Acta Cryst. B80, 695-705.
Search for missing symmetry in the Inorganic Crystal Structure Database (ICSD). (2024). Acta Cryst. B80, 451-455.
Determining magnetic structures in GSAS-II using the Bilbao Crystallographic Server tool k-SUBGROUPSMAG. (2024). Acta Cryst. B80, 424-429.
Crystal structure analysis of van der Waals layered phosphorus chalcogenide CuVP2S6. (2025). Acta Cryst. B81, 565-571.
The Ammann–Kramer–Neri tiling model of a P-ZnMgEr Bergman-type quasicrystal based on in-house X-ray diffraction. (2026). Acta Cryst. B82, 175-185.
New insights into the magnetism and magnetic structure of LuCrO3 perovskite. (2024). Acta Cryst. B80, 377-384.
A case for resonant X-ray Bragg diffraction by a collinear antiferromagnet Li2Ni3P4O14. (2025). Acta Cryst. B81, 582-586.
DMSO solvates of tert-butylcalix[6]arene and related multisolvent structures. (2025). Acta Cryst. B81, 517-527.
Structures of phosphonitrides in light of the extended Zintl–Klemm concept. (2025). Acta Cryst. B81, 378-394.
Prediction and analysis of symmetry-raising transitions in anilinium tetrafluoroborate. (2025). Acta Cryst. B81, 587-594.
K0.72Na1.71Ca5.79Si6O19 – the first oligosilicate based on [Si6O19]-hexamers and its stability compared to cyclosilicates. (2024). Acta Cryst. B80, 474-487.
The complex stacking disorder of Fe- and Ru-based 1,1′-(3,6-pyrazabolyl)metallocenes. (2026). Acta Cryst. B82, 22-33.
Quantitative analysis of facet growth during directional solidification of salol. (2026). Acta Cryst. B82, 143-153.
Unravelling superstructure and electronic ordering in LiNiO2 bulk single crystals grown by optical floating zone technique. (2026). Acta Cryst. B82, 154-158.
AB2X4 spinel structures: similarity and differences between the centrosymmetric, Fd3m, and non-centrosymmetric, F4132, space groups. (2026). Acta Cryst. B82, 360-366.
Probing the local structure of Bi2O3 chemical derivatives: the neglected cation sublattice. (2025). Acta Cryst. B81, 595-604.
Magnetic structure determination of multiple phases in the multiferroic candidate GdCrO3. (2025). Acta Cryst. B81, 293-301.
A comprehensive characterization of thiophosgene in the solid state. (2024). Acta Cryst. B80, 495-503.
A linear/quadratic order parameter coupling description of the Verwey transition in magnetite, Fe3O4. (2025). Acta Cryst. B81, 427-436.
Synthesis and characterization of an organic–inorganic hybrid crystal: 2[Co(en)3](V4O13)·4H2O. (2024). Acta Cryst. B80, 488-494.
Role of restraints on hydrogen atoms in Hirshfeld atom refinement: the case of tri-aspartic acid trihydrate. (2025). Acta Cryst. B81, 484-497.
Structural and magnetic properties of β-Li2IrO3 after grazing-angle focused ion beam thinning. (2025). Acta Cryst. B81, 202-207.
Understanding and rationalizing the structure of ionic solids by computational application of Beck's extended coordination number rule. (2026). Acta Cryst. B82, 224-236.
Computation screening for incorrectly determined cocrystal structures. (2025). Acta Cryst. B81, 208-216.
Multipolar model and Hirshfeld atom refinement of tetraaquabis(hydrogenmaleato)iron(II). (2025). Acta Cryst. B81, 350-362.
Form (III) of artemisinin: discovery and crystallographic characterization of a new high-pressure polymorph. (2026). Acta Cryst. B82, 316-329.
Structural and magnetic investigations of the Weyl semimetal family CeAlSi1–xGex. (2026). Acta Cryst. B82, 250-257.
Synthesis and properties of Sr2La2NiW2O12, a new S = 1 triangular lattice magnet. (2024). Acta Cryst. B80, 467-473.
Maus's salts: an old family of iron sulfates with possible magnetic frustration. (2026). Acta Cryst. B82, 268-279.
Symmetry, magnetic transitions and multiferroic properties of B-site-ordered A2MnB′O6 perovskites (B′ = [Co, Ni]). (2024). Acta Cryst. B80, 665-675.
Deciphering unusually large modulations in two related organic hydroxy channel structures. (2026). Acta Cryst. B82, 375-390.
Unveiling the structure and interactions of silicene grown on MoS2: insights from hybrid molecular dynamics simulations. (2025). Acta Cryst. B81, 533-539.
L-threo-D-galacto-Octitol: a curious non-classical order–disorder polytype with an 88 Å axis. (2026). Acta Cryst. B82, 352-359.
Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe3+-doped single-crystal samples. (2025). Acta Cryst. B81, 84-91.
EuPdSn2: magnetic structures in view of resonant X-ray Bragg diffraction. (2025). Acta Cryst. B81, 440-444.
Computational analysis tools for magnetic structures in the Bilbao Crystallographic Server. (2025). Acta Cryst. B81, 181-191.
Re-refinement of the structure of the planar hexagonal phase of ZnO nanocrystals. (2026). Acta Cryst. B82, 310-315.
Mapping structure–property relationships in a 6-oxo-verdazyl radical by variable pressure crystallography and density functional theory. (2026). Acta Cryst. B82, 416-432.
High-pressure and high-temperature polymorphism of Na2CO3 up to 10 GPa. (2026). Acta Cryst. B82, 410-415.
Photoelasticity of crystals with the scheelite structure: quantum mechanical calculations. (2025). Acta Cryst. B81, 47-54.
Introducing the special issue on current research in crystal growth and related characterization. (2026). Acta Cryst. B82, 247-249.
Structural modification of functionalized carbazoles: from Z′ = 1 to Z′ = 6. (2026). Acta Cryst. B82, 339-343.
The seventh blind test highlights exciting developments in crystal structure prediction. (2024). Acta Cryst. B80, 514-516.
Crystalline mate strategy for berberine hydrochloride: solvent-polarity-tuned co-crystallization. (2026). Acta Cryst. B82, 159-164.
Subtle details revealed via powder diffraction and validated by charge flipping. (2025). Acta Cryst. B81, 500-501.
Crystal growth, structure and infrared absorption of co-doped (Cr, Co, Fe):ZnSe single crystals. (2026). Acta Cryst. B82, 112-119.
The glycolipid flocculosin-A from the fungus Anthracocystis flocculosa, or how to deal with cotton-wool-like crystals. (2025). Acta Cryst. B81, 502-505.
Electric charge and salting in/out effects on glucagon's dipole moments and polarizabilities using the GruPol database. (2025). Acta Cryst. B81, 192-201.
Incommensurately modulated structures of the M1/8Pr5/8MoO4 (M = Li, Na, K) scheelites. (2026). Acta Cryst. B82, 120-130.
Synthesis of g-C3N4/TiO2-based photocatalysts for hydrogen production from organic substrates. (2026). Acta Cryst. B82, 186-194.
Coupled intra- and inter-tunnel short-range order in hollandites: a case study of mannardite Ba[(Ti4+)6(V3+)2]O16. (2026). Acta Cryst. B82, 439-446.
Elastic and piezoelectric properties of (R)-3-quinuclinidol under pressure: a quantum crystallography study. (2026). Acta Cryst. B82, 90-97.
Structure evolution and high-temperature luminescence versus negative thermal expansion of Ho,Tm-doped Yb2Mo3O12 crystals. (2026). Acta Cryst. B82, 165-174.
Modelling the structural evolution and polytypism of micas by tetrahedral transformation and polyhedral volumes. (2026). Acta Cryst. B82, 34-53.
Three polytypes of lapachol, a natural pigment with promising pharmacological properties. Corrigendum. (2026). Acta Cryst. B82, 246.
Thermal decomposition of ZnO2 to ZnO: driven by peroxide bond rupture and shear-induced stacking faults. (2026). Acta Cryst. B82, 61-67.
Growth of sea-urchin-like platinum nanoparticles and their applications. (2026). Acta Cryst. B82, 78-89.
Three polytypes of lapachol, a natural pigment with promising pharmacological properties. (2026). Acta Cryst. B82, 54-60.
Correcting long-range electrostatic interactions in multiple hydrogen-bonded systems by experimental electron density. (2026). Acta Cryst. B82, 237-245.
Dehydration, polymorphism and ionic conductivity of sodium hypodiphosphates. (2026). Acta Cryst. B82, 209-223.
Contrasting conformational behaviors of molecules XXXI and XXXII in the seventh blind test of crystal structure prediction. (2024). Acta Cryst. B80, 606-619.
Unravelling the complexity of co-existing phases in piezoelectrics. (2025). Acta Cryst. B81, 291-292.
Sodium dodecyl sulfate induced formation of a messy structure methane hydrate: a molecular dynamics simulation study. (2026). Acta Cryst. B82, 203-208.
Random in-plane translational stacking faults in the van der Waals superlattice Ba6Nb11Se28. (2026). Acta Cryst. B82, 369-374.

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