PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure
Тип публикации: Journal Article
Дата публикации: 2010-05-07
scimago Q3
БС3
SJR: 0.292
CiteScore: 2.7
Impact factor: —
ISSN: 00442313, 15213749, 08631786
Inorganic Chemistry
Краткое описание
The intermetallic compound PdZn was reported to have two modifications, the tetragonal CuAu-type low-temperature phase and the cubic CsCl-type high-temperature phase. The existence of the cubic high-temperature phase at the equiatomic composition could not be proven experimentally. Calculations of the total energy reveal a minimum at c/a = 1.155, clearly excluding the cubic structure at the equiatomic composition in the system Pd-Zn. Analysis of the chemical bonding applying the electron localizability approach reveals charge transfer from zinc to palladium and proves direct Pd–Pd interactions in the (001) plane to be the main reason for the tetragonal distortion of the cubic CsCl-type structural pattern for ZnPd.
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Friedrich M. et al. PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure // Zeitschrift fur Anorganische und Allgemeine Chemie. 2010. Vol. 636. No. 9-10. pp. 1735-1739.
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Friedrich M., Ormeci A., Grin Y., Armbrüster M. PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure // Zeitschrift fur Anorganische und Allgemeine Chemie. 2010. Vol. 636. No. 9-10. pp. 1735-1739.
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RIS
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TY - JOUR
DO - 10.1002/zaac.201000097
UR - https://doi.org/10.1002/zaac.201000097
TI - PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure
T2 - Zeitschrift fur Anorganische und Allgemeine Chemie
AU - Friedrich, Matthias
AU - Ormeci, Alim
AU - Grin, Yuri
AU - Armbrüster, Marc
PY - 2010
DA - 2010/05/07
PB - Wiley
SP - 1735-1739
IS - 9-10
VL - 636
SN - 0044-2313
SN - 1521-3749
SN - 0863-1786
ER -
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BibTex (до 50 авторов)
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@article{2010_Friedrich,
author = {Matthias Friedrich and Alim Ormeci and Yuri Grin and Marc Armbrüster},
title = {PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure},
journal = {Zeitschrift fur Anorganische und Allgemeine Chemie},
year = {2010},
volume = {636},
publisher = {Wiley},
month = {may},
url = {https://doi.org/10.1002/zaac.201000097},
number = {9-10},
pages = {1735--1739},
doi = {10.1002/zaac.201000097}
}
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MLA
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Friedrich, Matthias, et al. “PdZn or ZnPd: Charge Transfer and Pd–Pd Bonding as the Driving Force for the Tetragonal Distortion of the Cubic Crystal Structure.” Zeitschrift fur Anorganische und Allgemeine Chemie, vol. 636, no. 9-10, May. 2010, pp. 1735-1739. https://doi.org/10.1002/zaac.201000097.