Computational insight on the structural, mechanical and thermal properties of Cu₂CdSnSe₄ and Cu₂HgSnSe₄ adamantine materials
Through first-principles calculation based on the density functional theory (DFT) within the pseudo potentialplane wave (PP-PW) approach, we studied the structural, mechanical and thermal properties of Cu₂CdSnSe₄ and Cu₂HgSnSe₄ adamantine materials. The calculated lattice parameters are in good ag...
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| Date: | 2016 |
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| Main Authors: | , , |
| Format: | Article |
| Language: | English |
| Published: |
Інститут фізики конденсованих систем НАН України
2016
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| Series: | Condensed Matter Physics |
| Online Access: | http://dspace.nbuv.gov.ua/handle/123456789/156538 |
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| Journal Title: | Digital Library of Periodicals of National Academy of Sciences of Ukraine |
| Cite this: | Computational insight on the structural, mechanical and thermal properties of Cu₂CdSnSe₄ and Cu₂HgSnSe₄ adamantine materials / S. Bensalem, M. Chegaar, A. Bouhemadou // Condensed Matter Physics. — 2016. — Т. 19, № 4. — С. 43601: 1–10. — Бібліогр.: 41 назв. — англ. |