Works matching IS 20525192 AND DT 2017 AND VI 73 AND IP 5

Results: 30

A commensurately modulated structure of parabutlerite, FeIIISO4(OH)·2H2O.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 856, doi. 10.1107/S2052520617007156

By:

Plášil, Jakub;
Petříček, Václav;
Majzlan, Juraj

Publication type:

Article

Non-covalent interactions in the multicomponent crystal of 1-aminocyclopentane carboxylic acid, oxalic acid and water: a crystallographic and a theoretical approach.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 968, doi. 10.1107/S2052520617011775

By:

Mora, Asiloé J.;
Belandria, Lusbely M.;
Delgado, Gerzon E.;
Seijas, Luis E.;
Lunar, Angel;
Almeida, Rafael

Publication type:

Article

Symmetry Relationships between Crystal Structures. By Ulrich Müller. IUCr/Oxford Science Publications. 2017. Paperback Pp. 352. Price GBP 29.99. ISBN 9780198807209.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 1017, doi. 10.1107/S2052520617011283

By:

Nespolo, Massimo

Publication type:

Article

Crystal structure of the OH-dominant gadolinite-(Y) analogue (Y,Ca)2(Fe,□)Be2Si2O8(OH,O)2 from Heftetjern pegmatite, Norway.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 899, doi. 10.1107/S2052520617006588

By:

Chukanov, Nikita V.;
Aksenov, Sergey M.;
Rastsvetaeva, Ramiza K.;
Kristiansen, Roy;
Pekov, Igor V.;
Belakovskiy, Dmitriy I.;
Van, Konstantin V.;
Bychkova, Yana V.;
Britvin, Sergey N.

Publication type:

Article

Incommensurately modulated structure of morpholinium tetrafluoroborate and configurational versus chemical entropies at the incommensurate and lock-in phase transitions.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 836, doi. 10.1107/S2052520617009398

By:

Noohinejad, Leila;
Van Smaalen, Sander;
Petříček, Václav;
Schönleber, Andreas

Publication type:

Article

Non-order-disorder allotwinning of the rhenium pincer complex cis-Re[(PNPCH2- iPr)(CO)2Cl].

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 941, doi. 10.1107/S205252061701006X

By:

Glatz, Mathias;
Stöger, Berthold;
Kirchner, Karl

Publication type:

Article

Empirical Lewis acid strengths for 135 cations bonded to oxygen.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 956, doi. 10.1107/S2052520617010988

By:

Gagné, Olivier Charles;
Hawthorne, Frank Christopher

Publication type:

Article

Evolution of the α-BaMg(CO3)2 low-temperature superstructure and the tricritical nature of its α-β phase transition.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 827, doi. 10.1107/S2052520617009295

By:

Ende, Martin;
Effenberger, Herta;
Miletich, Ronald

Publication type:

Article

Effect of cationic substitution on the double-well hydrogen-bond potential in [K1− x(NH4) x]3H(SO4)2 proton conductors: a single-crystal neutron diffraction study.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 863, doi. 10.1107/S2052520617008642

By:

Choudhury, R. R.;
Chitra, R.;
Selezneva, E. V.;
Makarova, I. P.

Publication type:

Article

Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba2RE2Si4O12F2 (RE = Er3+-Lu3+) and Ba2RE2Si4O13 (RE = La3+-Ho3+)

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 907, doi. 10.1107/S2052520617009544

By:

Fulle, Kyle;
Sanjeewa, Liurukara D.;
Mcmillen, Colin D.;
Kolis, Joseph W.

Publication type:

Article

Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 879, doi. 10.1107/S2052520617009520

By:

Chia, Tze Shyang;
Quah, Ching Kheng

Publication type:

Article

Imperfections in crystalline solids. By Wei Cai and William D. Nix. MRS-Cambridge Materials Fundamentals. Cambridge University Press, 2016. Paperback Pp. 532. Price GBP 44.99. ISBN 1107123135.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 1018, doi. 10.1107/S2052520617007594

By:

Gratias, Denis

Publication type:

Article

Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 844, doi. 10.1107/S2052520617006412

By:

Binns, Jack;
Mcintyre, Garry J;
Barreda-Argüeso, José A.;
González, Jesús;
Aguado, Fernando;
Rodríguez, Fernando;
Valiente, Rafael;
Parsons, Simon

Publication type:

Article

Quantitative characterization of new supramolecular synthons involving fluorine atoms in the crystal structures of di- and tetrafluorinated benzamides.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 805, doi. 10.1107/S2052520617006114

By:

Mondal, Pradip Kumar;
Yadav, Hare Ram;
Choudhury, Angshuman Roy;
Chopra, Deepak

Publication type:

Article

Multidimensional structural variation in the cyanotrichite family of merotypes: camerolaite-3 b- F.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 950, doi. 10.1107/S2052520617010769

By:

Mills, Stuart J.;
Christy, Andrew G.;
Favreau, Georges;
Galea-Clolus, Valérie

Publication type:

Article

Approaches to crystal structure landscape exploration.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 775, doi. 10.1107/S205252061700960X

By:

Desiraju, Gautam R.

Publication type:

Article

A note on the distortion theorem.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 874, doi. 10.1107/S205252061700912X

By:

Nickolsky, M. S.

Publication type:

Article

3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 981, doi. 10.1107/S2052520617011118

By:

Truong, Khai-Nghi;
Merkens, Carina;
Englert, Ulli

Publication type:

Article

Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 781, doi. 10.1107/S2052520617006643

By:

Dey, Dhananjay;
Chopra, Deepak

Publication type:

Article

Markedly different molecular formation in DPP-based small-molecule solar cells probed by grazing-incidence wide-angle X-ray scattering.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 916, doi. 10.1107/S2052520617009933

By:

Kim, Yu Jin;
Song, Chang Eun;
Suranagi, Sanjaykumar R.;
Lee, Jong-Cheol;
Park, Chan Eon

Publication type:

Article

First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 1007, doi. 10.1107/S2052520617011477

By:

Sarmah, Kashyap Kumar;
Rajbongshi, Trishna;
Bhowmick, Sourav;
Thakuria, Ranjit

Publication type:

Article

Using invariom modelling to distinguish correct and incorrect central atoms in `duplicate structures' with neighbouring 3 d elements.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 794, doi. 10.1107/S2052520617010745

By:

Wandtke, Claudia M.;
Weil, Matthias;
Simpson, Jim;
Dittrich, Birger

Publication type:

Article

Crystal structure of cobalt hydroxide carbonate Co2CO3(OH)2: density functional theory and X-ray diffraction investigation.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 868, doi. 10.1107/S2052520617007983

By:

González-López, Jorge;
Cockcroft, Jeremy K.;
Fernández-González, Ángeles;
Jimenez, Amalia;
Grau-Crespo, Ricardo

Publication type:

Article

Predicting displacements of octahedral cations in ferroelectric perovskites using machine learning.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 962, doi. 10.1107/S2052520617011945

By:

Balachandran, Prasanna V.;
Shearman, Toby;
Theiler, James;
Lookman, Turab

Publication type:

Article

Structural changes of relaxor ferroelectric Sr0.52Ba0.48Nb2O6 (SBN52) on quenching and reheating.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 820, doi. 10.1107/S2052520617007880

By:

Graetsch, Heribert A.

Publication type:

Article

Low-temperature behaviour of K2Sc[Si2O6]F: determination of the lock-in phase and its relationships with fresnoite- and melilite-type compounds.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 923, doi. 10.1107/S2052520617010241

By:

Hejny, C.;
Bindi, L.

Publication type:

Article

Investigations of the phase relations among e1, e2 and C structures of Na-rich plagioclase feldspars: a single-crystal X-ray diffraction study.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 992, doi. 10.1107/S2052520617010976

By:

Jin, Shiyun;
Xu, Huifang

Publication type:

Article

Ascertaining the correctness of the assigned central 3 d transition metal in coordination complexes.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 779, doi. 10.1107/S2052520617013579

By:

Farrugia, Louis J.

Publication type:

Article

The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 931, doi. 10.1107/S2052520617010630

By:

Filsø, Mette Ø.;
Chaaban, Iman;
Al Shehabi, Amer;
Skibsted, Jørgen;
Lock, Nina

Publication type:

Article

Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates.

Published in:

Acta Crystallographica Section B: Structural Science, Crystal Engineering & Materials, 2017, v. 73, n. 5, p. 891, doi. 10.1107/S2052520617006011

By:

Zhou, Xinbo;
Hu, Xiurong;
Gu, Jianming;
Zhu, Jianrong

Publication type:

Article

Works matching IS 20525192 AND DT 2017 AND VI 73 AND IP 5

A commensurately modulated structure of parabutlerite, Fe<sup>III</sup>SO<sub>4</sub>(OH)·2H<sub>2</sub>O.

Non-covalent interactions in the multicomponent crystal of 1-aminocyclopentane carboxylic acid, oxalic acid and water: a crystallographic and a theoretical approach.

Symmetry Relationships between Crystal Structures. By Ulrich Müller. IUCr/Oxford Science Publications. 2017. Paperback Pp. 352. Price GBP 29.99. ISBN 9780198807209.

Crystal structure of the OH-dominant gadolinite-(Y) analogue (Y,Ca)<sub>2</sub>(Fe,□)Be<sub>2</sub>Si<sub>2</sub>O<sub>8</sub>(OH,O)<sub>2</sub> from Heftetjern pegmatite, Norway.

Incommensurately modulated structure of morpholinium tetrafluoroborate and configurational versus chemical entropies at the incommensurate and lock-in phase transitions.

Non-order-disorder allotwinning of the rhenium pincer complex cis-Re[(PNP<sup>CH2</sup>- iPr)(CO)<sub>2</sub>Cl].

Empirical Lewis acid strengths for 135 cations bonded to oxygen.

Evolution of the α-BaMg(CO<sub>3</sub>)<sub>2</sub> low-temperature superstructure and the tricritical nature of its α-β phase transition.

Effect of cationic substitution on the double-well hydrogen-bond potential in [K<sub>1− x</sub>(NH<sub>4</sub>) <sub>x</sub>]<sub>3</sub>H(SO<sub>4</sub>)<sub>2</sub> proton conductors: a single-crystal neutron diffraction study.

Crystal chemistry and the role of ionic radius in rare earth tetrasilicates: Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>12</sub>F<sub>2</sub> (RE = Er<sup>3+</sup>-Lu<sup>3+</sup>) and Ba<sub>2</sub>RE<sub>2</sub>Si<sub>4</sub>O<sub>13</sub> (RE = La<sup>3+</sup>-Ho<sup>3+</sup>)

Temperature-induced order-disorder structural phase transitions of two-dimensional isostructural hexamethylenetetramine co-crystals.

Imperfections in crystalline solids. By Wei Cai and William D. Nix. MRS-Cambridge Materials Fundamentals. Cambridge University Press, 2016. Paperback Pp. 532. Price GBP 44.99. ISBN 1107123135.

Phase transition sequences in tetramethylammonium tetrachlorometallates by X-ray diffraction and spectroscopic measurements.

Quantitative characterization of new supramolecular synthons involving fluorine atoms in the crystal structures of di- and tetrafluorinated benzamides.

Multidimensional structural variation in the cyanotrichite family of merotypes: camerolaite-3 b- F.

Approaches to crystal structure landscape exploration.

A note on the distortion theorem.

3-(Pyridin-4-yl)acetylacetone: a donor ligand towards mercury(II) halides and a versatile linker for complex materials.

Quantitative analysis of solid-state diversity in trifluoromethylated phenylhydrazones.

Markedly different molecular formation in DPP-based small-molecule solar cells probed by grazing-incidence wide-angle X-ray scattering.

First-line antituberculosis drug, pyrazinamide, its pharmaceutically relevant cocrystals and a salt.

Using invariom modelling to distinguish correct and incorrect central atoms in `duplicate structures' with neighbouring 3 d elements.

Crystal structure of cobalt hydroxide carbonate Co<sub>2</sub>CO<sub>3</sub>(OH)<sub>2</sub>: density functional theory and X-ray diffraction investigation.

Predicting displacements of octahedral cations in ferroelectric perovskites using machine learning.

Structural changes of relaxor ferroelectric Sr<sub>0.52</sub>Ba<sub>0.48</sub>Nb<sub>2</sub>O<sub>6</sub> (SBN52) on quenching and reheating.

Low-temperature behaviour of K<sub>2</sub>Sc[Si<sub>2</sub>O<sub>6</sub>]F: determination of the lock-in phase and its relationships with fresnoite- and melilite-type compounds.

Investigations of the phase relations among e1, e2 and C structures of Na-rich plagioclase feldspars: a single-crystal X-ray diffraction study.

Ascertaining the correctness of the assigned central 3 d transition metal in coordination complexes.

The structure-directing amine changes everything: structures and optical properties of two-dimensional thiostannates.

Comparison of the crystal structures and thermochemistry of a novel soluble guanylate cyclase stimulator riociguat and its solvates.