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Development of spin‐contrast‐variation neutron powder diffractometry for extracting the structure factor of hydrogen atoms.

Authors :
Miura, Daisuke
Kumada, Takayuki
Sekine, Yurina
Motokawa, Ryuhei
Nakagawa, Hiroshi
Oba, Yojiro
Ohhara, Takashi
Takata, Shin-ichi
Hiroi, Kosuke
Morikawa, Toshiaki
Kawamura, Yukihiko
Ohishi, Kazuki
Suzuki, Jun-ichi
Miyachi, Yoshiyuki
Iwata, Takahiro
Source :
Journal of Applied Crystallography; Apr2021, Vol. 54 Issue 2, p454-460, 7p
Publication Year :
2021

Abstract

A spin‐contrast‐variation neutron powder diffractometry technique that extracts the structure factor of hydrogen atoms, i.e. the contribution of hydrogen atoms to a crystal's structure factor, has been developed. Crystals of l‐glutamic acid were dispersed in a d‐polystyrene matrix containing 4‐methacryloyloxy‐2,2,6,6,‐tetramethyl‐1‐piperidinyloxy to polarize their proton spins dynamically. The intensities of the diffraction peaks of the sample changed according to the proton polarization, and the structure factor of the hydrogen atoms was extracted from the proton‐polarization‐dependent intensities. This technique is expected to enable analyses of the structures of hydrogen‐containing materials that are difficult to determine with conventional powder diffractometry. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00218898
Volume :
54
Issue :
2
Database :
Complementary Index
Journal :
Journal of Applied Crystallography
Publication Type :
Academic Journal
Accession number :
149664053
Full Text :
https://doi.org/10.1107/S1600576721000303