OOIR: Observatory of International Research

Papers

(The TQCC of Acta Crystallographica Section B-Structural Science Crystal Engineerin is 3. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-05-01 to 2025-05-01.)

Article	Citations
Structural reasons for the formation of multicomponent products and the influence of high pressure	28
One-dimensional diffuse scattering of 1,3-di(tert-butyl)cyclopentadienyl pentaphosphaferrocene modelled with closed-form expressions	21
Ab initio crystal structures and relative phase stabilities for the aleksite series, Pb_nBi₄Te₄S	19
Synthesis and structural characterization of a new dinuclear platinum(III) complex, [Pt₂Cl₄(NH₃)₂{μ-HN=C(O)Bu^t}₂], and Synthesis and s	19
Effect of La doping on the structure and cycloidal spin ordering in multiferroic BiFeO₃	18
A new home for studies of crystal growth and characterisation	17
Circumventing a challenging aspect of crystal structure determination from powder diffraction data	17
Low-temperature phase transition and high-pressure phase stability of 1H-pyrazole-1-carboxamidine nitrate	15
Crystal engineering of co-crystal of nicotinic acid and pyrogallol: an experimental and theoretical electron density analysis	15
Zharchikhite, AlF(OH)₂: a novel structure type related to α-PbO₂	12
Synthesis and characterization of an organic–inorganic hybrid crystal: 2[Co(en)₃](V₄O₁₃)·4H₂O	12
Cs₄Ca[Si₈O₁₉]: a new mixed tetrahedral–octahedral oxosilicate, its topological features and comparison with other interrupted framework silicates	12
A survey of thermal expansion coefficients for organic molecular crystals in the Cambridge Structural Database	12
Is it possible to obtain a plausible experimental electronic structure without collecting high-order diffraction data?	12
Magnetic structure of the noncentrosymmetric magnet Sr₂MnSi₂O₇ through irreducible representation and magnetic space group analyses	11
Mapping high-pressure crystallography in a structural chemistry landscape	11
New data on the crystal chemistry of the natural two-layer aluminosilicates latiumite and tuscanite	11
Exploring the thermal behaviour of the solvated structures of nifedipine	11
Synthesis and structural study of the partially disordered complex hexagonal phase δ₁-MnZn_9.7	11
Gladstone–Dale compatibility, electronic polarizability and vibrational spectroscopy of minerals and inorganic compounds with V⁴⁺O and V⁴⁺O₂ vanadyl groups	9
Structure determination from unindexed powder data from scratch by a global optimization approach using pattern comparison based on cross-correlation functions	9
Contrasting conformational behaviors of molecules XXXI and XXXII in the seventh blind test of crystal structure prediction	9
Polymorphism of Pb₅(PO₄)₃OH_δ within the LK-99 mixture	9
SARAh – web representational analysis	9
A new guaninate hydrate K⁺·C₅H₄N₅O⁻·H₂O: crystal structure from 100 to 300 K in a comparison with 2Na⁺·C₅H₃	9

Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol	8
Properties and interactions – melting point of tribromobenzene isomers	8
Formation of contact and multiple cyclic cassiterite twins in SnO₂-based ceramics co-doped with cobalt and niobium oxides	8
Correlated disorder and crystal structure of β-VOSO₄	8
Conformational disorder in quercetin dihydrate revealed from ultrahigh-resolution synchrotron diffraction	8
Morphotropism in fumarolic mineral-related anhydrous sulfates: novel representatives in A ⁺ ₂ M	8
Crystal structure solution and high-temperature thermal expansion in NaZr₂(PO₄)₃-type materials	7
Molecular structures of two copper complexes with the pharmaceuticals norfloxacin and tinidazole, when powder X-ray diffraction assists multi-domain single-crystal X-ray diffraction	7
Crystal structure and doping in synthetic enstatite: an analysis of Li/Fe³⁺-doped single-crystal samples	7
Guidelines for communicating commensurate magnetic structures. A report of the International Union of Crystallography Commission on Magnetic Structures	7
Pushing crystallography's frontiers through quantum mechanics	7
The physical space model of the Tsai-type quasicrystal	7
Effect of pre-rolling aging treatment on evolutions of the microstructure and the texture of aluminium alloy 7005 subjected to heavy cold rolling	6
Developing orbital-free quantum crystallography: the local potentials and associated partial charge densities	6
A new topological semimetal candidate: SmMnBi₂	6
A rare case of Na/Zn isomorphism in the crystal structure of non-centrosymmetric zincophosphate Na₅Zn[Zn(PO₄)₃]	6
Structure stabilization effect of vacancies and entropy in hexagonal WN	6
Design and synthesis of diverse Cd²⁺/Zn²⁺/Cu²⁺ coordination polymers tuned by dicarboxylate and auxiliary 1,4-bis(pyridin-4-ylmethyl)piperazine ligands with luminescen	6
Attractive and repulsive forces in a crystal of [Rb(18-crown-6)][SbCl₆] under high pressure	6
X-ray constrained wavefunctions based on Hirshfeld atoms. I. Method and review	5
How much do molecular shapes matter?	5
The seventh blind test highlights exciting developments in crystal structure prediction	5
Site-occupancy scheme in disordered Ca₃RE₂(BO₃)₄: a dependence on rare-earth (RE) ionic radius	5
The influence of chalcogen atom on conformation and phase transition in chalcogenazinoquinolinium monoiodides	5
Structures and phase transitions in barium sodium niobate tungsten bronze (BNN)	5
Refinement of the crystal structure of fresnoite, Ba₂TiSi₂O₈, from Löhley (Eifel district, Germany); Gladstone–Dale compatibility, electronic polarizability and vibrat	5
Quantitative crystal structure analysis in trifluoromethyl- and cyano-substituted N-phenylbenzamides	5
Spin-resolved charge density and wavefunction refinements using MOLLYNX: a review	5
Response to comment on Properties and interactions – melting point of tribromobenzene isomers	5
Three-dimensional electron diffraction on clinkers: the belite α′_H incommensurate modulated structure	5
Density functional theory investigation of the phase transition, elastic and thermal characteristics for AuMTe₂(M = Ga, In) chalcopyrite compounds	4
Analytic description of nanowires II: morphing of regular cross sections for zincblende- and diamond-structures to match arbitrary shapes. Corrigendum	4
Hydrogen bonding patterns and C—H...π interactions in the structure of the antiparkinsonian drug (R)-rasagiline mesylate determined using laboratory and synchrotron X-ray powder diffraction dat	4
Evolution of intermolecular contacts with temperature and pressure in bromoethane and iodoethane – a comparative study	4
Compressibility of structural modulation waves in the chain compounds BaCoX ₂O₇ (X = As, P): a powder study	4
Solid-state electronegativity of atoms: new approaches	4
Modulation of the modulated magnetic structure of an Ho i-MAX phase described by a magnetic (3+2)-dimensional superspace group	4
Insights into isostructural and non-isostructural crystals of esters of oleanolic acid and its 11-oxo derivatives	4
(Na,Li)₃(Cl,OH)[Cu₃OAl(PO₄)₃]: a first salt-inclusion aluminophosphate oxocuprate with a new type of crystal structure	4
Morphological control for hollow rod crystals of a photochromic diarylethene on spherulites by surface properties of substrates	4
Accurate H-atom parameters for the two polymorphs of L-histidine at 5, 105 and 295 K	4
Detailed analysis of deformation potentials with application in orbital-free density functional theory	4
Elastic and piezoelectric properties of β-glycine – a quantum crystallography view on intermolecular interactions and a high-pressure phase transition	3
Bromine versus chlorine substituent in breathing crystals of a copper(I) coordination compound with a triazolamine Schiff base	3
Investigation of polar crystalline materials containing hydrochlorothiazide: electron density distribution and optical properties	3
A comparison of the isostructural [Co(NH₃)₅NO₂]XNO₃ and [Co(NH₃)₅ONO]XNO₃, X = Cl⁻ or Br	3
Concomitant polymorphs of 2-imino-2H-chromene-3-carboxylic acid amide: experimental and quantum chemical study	3
Application of the method for visualization of noncovalent interactions in conformational polymorphs of four organic acids	3
Crystallization induced by fungi and bacteria	3
Polytypism of Ln(SeO₃)(HSeO₃)·2H₂O compounds: synthesis and crystal structure of the first monoclinic modification of Nd(SeO₃)(HSeO₃)·2H₂	3

Fast crystal growth of amorphous nimesulide: implication of surface effects	3
Strategic synthon approach in obtaining cocrystals and cocrystal polymorphs of a high-Z′ system deferiprone – an anti-thalassemia drug	3
Resolving the structure of V₃O₇·H₂O and Mo-substituted V₃O₇·H₂O	3
Current developments and trends in quantum crystallography	3
Crystal structure, XANES and charge distribution investigation of krennerite and sylvanite: analysis of Au—Te and Te—Te bonds in Au_1–xAg	3
A high-pressure single-crystal X-ray diffraction study of potassium guaninate hydrate, K⁺·C₅H₄N₅O⁻·H₂O	3
A general method for searching for homometric structures	3
A contribution to the crystal chemistry and topology of organic thiosulfates: bis(1-methylpiperazinium)·S₂O₃·H₂O versus 1-methylpiperazinediium·S₂O	3
Ultrasound-assisted synthesis of a Eu³⁺-functionalized Zn^II coordination polymer as a fluorescent dual detection probe for highly sensitive recognition of Hg^II and	3
N-Representable one-electron reduced density matrices reconstruction at non-zero temperatures	3
A previously unknown cyclic alkanolamine and molecular ranking using the pair distribution function	3
Effect of nano-SiC doping on the structure and superconducting properties of Mg(B_1–xC_x)₂	3
Structural studies of N-(methoxysalicylidene)-fluoroaniline, N-(methoxysalicylidene)-chloroaniline and N-(methoxysalicylidene)-bromoaniline derivatives	3
Investigation of crystal structures, energetics and isostructurality in halogen-substituted phosphoramidates	3
1-Allyl-4-hydroxy-2,2-dioxo-N-(4-methoxyphenyl)-1H-2λ⁶,1-benzothiazine-3-carboxamide: polymorphic transition due to grinding with the loss of the biological activity	3
The role of local heteropolyhedral substitutions in the stoichiometry, topological characteristics and ion-migration paths in the eudialyte-related structures: a quantitative analysis	3
Czochralski growth of mixed cubic sesquioxide crystals in the ternary system Lu₂O₃–Sc₂O₃–Y₂O₃	3
Analytic description of nanowires II: morphing of regular cross sections for zincblende- and diamond-structures to match arbitrary shapes	3
The effect of hydrostatic compression on the crystal structure of glycinium phosphite	3