Hydration/Dehydration Phase Transition Mechanism in Organic Crystals Investigated by Ab Initio Crystal Structure Determination from Powder Diffraction Data

Advances in Organic Crystal Chemistry ◽

10.1007/978-4-431-55555-1_15 ◽

2015 ◽

pp. 299-316

Author(s):

Kotaro Fujii ◽

Hidehiro Uekusa

Keyword(s):

Crystal Structure ◽

Phase Transition ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Organic Crystals ◽

Powder Diffraction Data ◽

Transition Mechanism

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Ab initio crystal structure determination of Bi6Rh12O29 from powder diffraction data

Zeitschrift für Kristallographie - Crystalline Materials ◽

10.1524/zkri.2006.221.3.206 ◽

2006 ◽

Vol 221 (3) ◽

Cited By ~ 3

Author(s):

Frank Stowasser ◽

Christof Renkenberger

Keyword(s):

Crystal Structure ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

Complex Crystal Structure ◽

Complex Crystal

AbstractThe complex crystal structure of Bi

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Ab initio Crystal Structure Determination of Na2Si3O7 from Conventional Powder Diffraction Data.

ChemInform ◽

10.1002/chin.200309006 ◽

2003 ◽

Vol 34 (9) ◽

Author(s):

V. Kahlenberg ◽

B. Marler ◽

J. C. Munoz Acevedo ◽

J. Patarin

Keyword(s):

Crystal Structure ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data

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Ab initio crystal structure determination of Na2Si3O7 from conventional powder diffraction data

Solid State Sciences ◽

10.1016/s1293-2558(02)00006-7 ◽

2002 ◽

Vol 4 (10) ◽

pp. 1285-1292 ◽

Cited By ~ 8

Author(s):

V. Kahlenberg ◽

B. Marler ◽

J.C. Muñoz Acevedo ◽

J. Patarin

Keyword(s):

Crystal Structure ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data

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Ab Initio Crystal Structure Determination of Three Pharmaceutical Compounds from X-Ray Powder Diffraction Data

Materials Science Forum ◽

10.4028/www.scientific.net/msf.378-381.582 ◽

2001 ◽

Vol 378-381 ◽

pp. 582-587 ◽

Cited By ~ 3

Author(s):

Julien Giovannini ◽

M.-A. Perrin ◽

D. Louër ◽

F. Leveiller

Keyword(s):

Crystal Structure ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Pharmaceutical Compounds ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

X Ray

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Interpreting structural motifs of molecular materials by way of crystal structure determination directly from powder diffraction data

Acta Crystallographica Section A Foundations of Crystallography ◽

10.1107/s0108767302090669 ◽

2002 ◽

Vol 58 (s1) ◽

pp. c141-c141

Author(s):

E. Y. Cheung ◽

K. D. M. Harris ◽

R. L. Johnston ◽

G. W. Turner ◽

S. Habershon ◽

...

Keyword(s):

Crystal Structure ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

Molecular Materials ◽

Structural Motifs

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The Ab initio crystal structure determination of CuPt3O6 from a combination of synchrotron X-ray and neutron powder diffraction data

Journal of Physics and Chemistry of Solids ◽

10.1016/0022-3697(91)90203-c ◽

1991 ◽

Vol 52 (10) ◽

pp. 1273-1279 ◽

Cited By ~ 5

Author(s):

J.A. Hriljac ◽

J.B. Parise ◽

G.H. Kwei ◽

K.B. Schwartz

Keyword(s):

Crystal Structure ◽

Ab Initio ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Neutron Powder Diffraction ◽

Powder Diffraction Data ◽

X Ray ◽

Neutron Powder Diffraction Data

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Differential evolution: crystal structure determination of a triclinic polymorph of adipamide from powder diffraction data

Chemical Communications ◽

10.1039/b200436d ◽

2002 ◽

pp. 880-881 ◽

Cited By ~ 14

Author(s):

Colin C. Seaton ◽

Maryjane Tremayne

Keyword(s):

Crystal Structure ◽

Differential Evolution ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data

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Multi-population evolutionary algorithm SPEA2 for crystal structure determination from X-ray powder diffraction data

IOP Conference Series Materials Science and Engineering ◽

10.1088/1757-899x/734/1/012102 ◽

2020 ◽

Vol 734 ◽

pp. 012102

Author(s):

A N Zaloga ◽

S V Burakov ◽

I S Yakimov ◽

K A Gusev ◽

P S Dubinin

Keyword(s):

Crystal Structure ◽

Evolutionary Algorithm ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

X Ray

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Inorganic–organic hybrid compounds: synthesis and crystal structure determination from powder diffraction data of Sn2[O3PCH2C6H4CH2PO3]

Solid State Sciences ◽

10.1016/s1293-2558(03)00054-2 ◽

2003 ◽

Vol 5 (4) ◽

pp. 629-634 ◽

Cited By ~ 19

Author(s):

Norbert Stock ◽

Nathalie Guillou ◽

Thomas Bein ◽

Gérard Férey

Keyword(s):

Crystal Structure ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

Synthesis And Crystal Structure ◽

Organic Hybrid ◽

Hybrid Compounds

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Crystal structure determination of AlVMoO7 from X-ray powder diffraction data

European Journal of Solid State and Inorganic Chemistry ◽

10.1016/s0992-4361(98)80028-3 ◽

1998 ◽

Vol 35 (6-7) ◽

pp. 519-530 ◽

Cited By ~ 2

Author(s):

K. Knorr ◽

P. Jakubus ◽

G. Dabrowska ◽

M. Kurzawa

Keyword(s):

Crystal Structure ◽

Powder Diffraction ◽

Diffraction Data ◽

Structure Determination ◽

Crystal Structure Determination ◽

Powder Diffraction Data ◽

X Ray

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