том 49 издание 6 страницы 2259-2269

FAULTS: a program for refinement of structures with extended defects

Тип публикацииJournal Article
Дата публикации2016-11-02
scimago Q1
wos Q1
БС1
SJR1.183
CiteScore8.5
Impact factor2.8
ISSN00218898, 16005767
General Biochemistry, Genetics and Molecular Biology
Краткое описание

The FAULTS program is a powerful tool for the refinement of diffraction patterns of materials with planar defects. A new release of the FAULTS program is herein presented, together with a number of new capabilities, aimed at improving the refinement process and evolving towards a more user-friendly approach. These include the possibility to refine multiple sets of single-crystal profiles of diffuse streaks, the visualization of the model structures, the possibility to add the diffracted intensities from secondary phases as background and the new DIFFaX2FAULTS converter, among others. Three examples related to battery materials are shown to illustrate the capabilities of the program.

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ГОСТ |
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Casas-Cabanas M. et al. FAULTS: a program for refinement of structures with extended defects // Journal of Applied Crystallography. 2016. Vol. 49. No. 6. pp. 2259-2269.
ГОСТ со всеми авторами (до 50) Скопировать
Casas-Cabanas M., Reynaud M., Rikarte J., Horbach P., Rodriguez-Carvajal J., Rodríguez-Carvajal J. FAULTS: a program for refinement of structures with extended defects // Journal of Applied Crystallography. 2016. Vol. 49. No. 6. pp. 2259-2269.
RIS |
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TY - JOUR
DO - 10.1107/S1600576716014473
UR - https://doi.org/10.1107/S1600576716014473
TI - FAULTS: a program for refinement of structures with extended defects
T2 - Journal of Applied Crystallography
AU - Casas-Cabanas, Montse
AU - Reynaud, Marine
AU - Rikarte, Jokin
AU - Horbach, Pavel
AU - Rodriguez-Carvajal, Juan
AU - Rodríguez-Carvajal, Juan
PY - 2016
DA - 2016/11/02
PB - International Union of Crystallography (IUCr)
SP - 2259-2269
IS - 6
VL - 49
SN - 0021-8898
SN - 1600-5767
ER -
BibTex |
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BibTex (до 50 авторов) Скопировать
@article{2016_Casas-Cabanas,
author = {Montse Casas-Cabanas and Marine Reynaud and Jokin Rikarte and Pavel Horbach and Juan Rodriguez-Carvajal and Juan Rodríguez-Carvajal},
title = {FAULTS: a program for refinement of structures with extended defects},
journal = {Journal of Applied Crystallography},
year = {2016},
volume = {49},
publisher = {International Union of Crystallography (IUCr)},
month = {nov},
url = {https://doi.org/10.1107/S1600576716014473},
number = {6},
pages = {2259--2269},
doi = {10.1107/S1600576716014473}
}
MLA
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Casas-Cabanas, Montse, et al. “FAULTS: a program for refinement of structures with extended defects.” Journal of Applied Crystallography, vol. 49, no. 6, Nov. 2016, pp. 2259-2269. https://doi.org/10.1107/S1600576716014473.