Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment
Valeeva A.A., Gusev A.I.
Publication type: Journal Article
Publication date: 2022-05-27
scimago Q3
wos Q3
SJR: 0.305
CiteScore: 3.0
Impact factor: 1.7
ISSN: 09599436, 1364551X
General Chemistry
Abstract
Possible models for the arrangement of hydrogen atoms in the sites of the cubic lattice of titanium oxyhydride TiO y H p with vacancies in the metallic and nonmetallic sublattices are considered for the first time. It has been established that interstitial H atoms in oxyhydrides occupy vacant octahedral sites 4( b ) of the oxygen sublattice. No displacement of H atoms in tetrahedral sites 8( c ) is observed.
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Valeeva A. A., Gusev A. I. Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment // Mendeleev Communications. 2022. Vol. 32. No. 3. pp. 302-304.
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Valeeva A. A., Gusev A. I. Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment // Mendeleev Communications. 2022. Vol. 32. No. 3. pp. 302-304.
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TY - JOUR
DO - 10.1016/j.mencom.2022.05.003
UR - https://doi.org/10.1016/j.mencom.2022.05.003
TI - Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment
T2 - Mendeleev Communications
AU - Valeeva, A A
AU - Gusev, A I
PY - 2022
DA - 2022/05/27
PB - OOO Zhurnal "Mendeleevskie Soobshcheniya"
SP - 302-304
IS - 3
VL - 32
SN - 0959-9436
SN - 1364-551X
ER -
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@article{2022_Valeeva,
author = {A A Valeeva and A I Gusev},
title = {Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment},
journal = {Mendeleev Communications},
year = {2022},
volume = {32},
publisher = {OOO Zhurnal "Mendeleevskie Soobshcheniya"},
month = {may},
url = {https://doi.org/10.1016/j.mencom.2022.05.003},
number = {3},
pages = {302--304},
doi = {10.1016/j.mencom.2022.05.003}
}
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MLA
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Valeeva, A. A., and A I Gusev. “Placement of H atoms in the crystal lattice of cubic titanium oxyhydride: Simulation and diffraction experiment.” Mendeleev Communications, vol. 32, no. 3, May. 2022, pp. 302-304. https://doi.org/10.1016/j.mencom.2022.05.003.
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