# | Title | Journal | Year | Citations |
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1 | The Cambridge Structural Database: a quarter of a million crystal structures and rising | Acta Crystallographica Section B: Structural Science | 2002 | 9,950 |
2 | Bond-valence parameters obtained from a systematic analysis of the Inorganic Crystal Structure Database | Acta Crystallographica Section B: Structural Science | 1985 | 8,620 |
3 | Bond-valence parameters for solids | Acta Crystallographica Section B: Structural Science | 1991 | 6,676 |
4 | New software for searching the Cambridge Structural Database and visualizing crystal structures | Acta Crystallographica Section B: Structural Science | 2002 | 2,791 |
5 | Graph-set analysis of hydrogen-bond patterns in organic crystals | Acta Crystallographica Section B: Structural Science | 1990 | 2,317 |
6 | Novel tools for visualizing and exploring intermolecular interactions in molecular crystals | Acta Crystallographica Section B: Structural Science | 2004 | 2,165 |
7 | Structure of a ferroelectric and ferroelastic monodomain crystal of the perovskite BiFeO3 | Acta Crystallographica Section B: Structural Science | 1990 | 1,207 |
8 | New developments in the Inorganic Crystal Structure Database (ICSD): accessibility in support of materials research and design | Acta Crystallographica Section B: Structural Science | 2002 | 1,050 |
9 | Octahedral Tilting in Perovskites. I. Geometrical Considerations | Acta Crystallographica Section B: Structural Science | 1997 | 949 |
10 | Investigation of the structure and phase transitions in the novel A-site substituted distorted perovskite compound Na0.5Bi0.5TiO3 | Acta Crystallographica Section B: Structural Science | 2002 | 845 |
11 | Formability of ABX 3 (X = F, Cl, Br, I) halide perovskites | Acta Crystallographica Section B: Structural Science | 2008 | 758 |
12 | Structures and transformation mechanisms of the η, γ and θ transition aluminas | Acta Crystallographica Section B: Structural Science | 1991 | 694 |
13 | Structural and thermal parameters for rutile and anatase | Acta Crystallographica Section B: Structural Science | 1991 | 657 |
14 | Chemical and steric constraints in inorganic solids | Acta Crystallographica Section B: Structural Science | 1992 | 653 |
15 | Group-Theoretical Analysis of Octahedral Tilting in Perovskites | Acta Crystallographica Section B: Structural Science | 1998 | 604 |
16 | Prediction of the crystal structures of perovskites using the software program SPuDS | Acta Crystallographica Section B: Structural Science | 2001 | 603 |
17 | On the location and disorder of the tetrapropylammonium (TPA) ion in zeolite ZSM-5 with improved framework accuracy | Acta Crystallographica Section B: Structural Science | 1987 | 602 |
18 | Octahedral Tilting in Perovskites. II. Structure Stabilizing Forces | Acta Crystallographica Section B: Structural Science | 1997 | 574 |
19 | The geometry of the reactive site and of the peptide groups in trypsin, trypsinogen and its complexes with inhibitors | Acta Crystallographica Section B: Structural Science | 1983 | 533 |
20 | Crystal structures of polynuclear aromatic hydrocarbons. Classification, rationalization and prediction from molecular structure | Acta Crystallographica Section B: Structural Science | 1989 | 517 |
21 | A revision of van der Waals atomic radii for molecular crystals: N, O, F, S, Cl, Se, Br and I bonded to carbon | Acta Crystallographica Section B: Structural Science | 1985 | 489 |
22 | Applications of the Cambridge Structural Database in organic chemistry and crystal chemistry | Acta Crystallographica Section B: Structural Science | 2002 | 475 |
23 | Defect structure dependence on composition in lithium niobate | Acta Crystallographica Section B: Structural Science | 1986 | 470 |
24 | Structures of ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction | Acta Crystallographica Section B: Structural Science | 1988 | 457 |
25 | Ordered double perovskites – a group-theoretical analysis | Acta Crystallographica Section B: Structural Science | 2003 | 450 |
26 | Structural Studies of Rutile-Type Metal Dioxides | Acta Crystallographica Section B: Structural Science | 1997 | 441 |
27 | Crystal Engineering: Strategies and Architectures | Acta Crystallographica Section B: Structural Science | 1997 | 441 |
28 | The structure of trititanate nanotubes | Acta Crystallographica Section B: Structural Science | 2002 | 433 |
29 | A test of crystal structure prediction of small organic molecules | Acta Crystallographica Section B: Structural Science | 2000 | 376 |
30 | A third blind test of crystal structure prediction | Acta Crystallographica Section B: Structural Science | 2005 | 373 |
31 | Significant progress in predicting the crystal structures of small organic molecules – a report on the fourth blind test | Acta Crystallographica Section B: Structural Science | 2009 | 371 |
32 | Lattice constants and thermal expansion of H2O and D2O ice Ih between 10 and 265 K | Acta Crystallographica Section B: Structural Science | 1994 | 370 |
33 | Topological analysis of the electron density in hydrogen bonds | Acta Crystallographica Section B: Structural Science | 1999 | 368 |
34 | The automatic searching for chemical bonds in inorganic crystal structures | Acta Crystallographica Section B: Structural Science | 1985 | 366 |
35 | Towards crystal structure prediction of complex organic compounds – a report on the fifth blind test | Acta Crystallographica Section B: Structural Science | 2011 | 358 |
36 | Bond lengths in organic and metal-organic compounds revisited:X—H bond lengths from neutron diffraction data | Acta Crystallographica Section B: Structural Science | 2010 | 357 |
37 | Structure refinement of commensurately modulated bismuth strontium tantalate, Bi2SrTa2O9 | Acta Crystallographica Section B: Structural Science | 1992 | 355 |
38 | Crystal structure prediction of small organic molecules: a second blind test | Acta Crystallographica Section B: Structural Science | 2002 | 334 |
39 | The geometry of the N–H...O=C hydrogen bond. 3. Hydrogen-bond distances and angles | Acta Crystallographica Section B: Structural Science | 1984 | 321 |
40 | Understanding and control of nucleation, growth, habit, dissolution and structure of two- and three-dimensional crystals using `tailor-made' auxiliaries | Acta Crystallographica Section B: Structural Science | 1995 | 321 |
41 | Structure refinement of commensurately modulated bismuth titanate, Bi4Ti3O12 | Acta Crystallographica Section B: Structural Science | 1990 | 315 |
42 | Carbonyl–Carbonyl Interactions can be Competitive with Hydrogen Bonds | Acta Crystallographica Section B: Structural Science | 1998 | 313 |
43 | Structural chemistry of vanadium oxides with open frameworks | Acta Crystallographica Section B: Structural Science | 1999 | 301 |
44 | Electron diffraction of tilted perovskites | Acta Crystallographica Section B: Structural Science | 2005 | 299 |
45 | Crystallochromy as a solid-state effect: correlation of molecular conformation, crystal packing and colour in perylene-3,4:9,10-bis(dicarboximide) pigments | Acta Crystallographica Section B: Structural Science | 1989 | 286 |
46 | Low-temperature structure of rubrene single crystals grown by vapor transport | Acta Crystallographica Section B: Structural Science | 2006 | 285 |
47 | Structures of stable and metastable Ge2Sb2Te5, an intermetallic compound in GeTe–Sb2Te3 pseudobinary systems | Acta Crystallographica Section B: Structural Science | 2004 | 283 |
48 | Atomic displacement, anharmonic thermal vibration, expansivity and pyroelectric coefficient thermal dependences in ZnO | Acta Crystallographica Section B: Structural Science | 1989 | 279 |
49 | Cryocrystallography of biological macromolecules: a generally applicable method | Acta Crystallographica Section B: Structural Science | 1988 | 268 |
50 | Jahn–Teller distortions, cation ordering and octahedral tilting in perovskites | Acta Crystallographica Section B: Structural Science | 2004 | 267 |