1. 
|
Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Solovyov L. A., Fedorov A. S., Kuzubov A. A.
Заглавие : Complete crystal structure of decafluorocyclohex-1-ene at 4.2 K from original neutron diffraction data
Место публикации : Acta Crystallogr. B: Wiley-Blackwell, 2014. - Vol. 70. - P.395-397. - ISSN 0108-7681, DOI 10.1107/S2052520613031028. - ISSN 1600-5740
Примечания : Cited References: 20
Предметные рубрики: AUGMENTED-WAVE METHOD
POWDER DIFFRACTION
NORMAL-BUTANE
REFINEMENT
DISORDER
Аннотация: The crystal structure model of decafluorocyclohex-1-ene at 4.2 K derived from simulated powder diffraction data and solid-state energy minimization [Smrcok et al. (2013). Acta Cryst. B69, 395-404] is found to be incomplete. In this study it is completed by an additional alternative molecular orientation revealed from the difference density analysis and direct space search. The structure is refined by the derivative difference method in the rigid-body approximation leading to perfect agreement between observed and calculated neutron powder patterns.
Смотреть статью,
Смотреть статью,
Scopus,
WOS,
Читать в сети ИФ
Найти похожие
|
Главная
Каталог книг и брошюр библиотеки ИФ СО РАН