Torsion and Axial Deformations of Chalcogen Helical Chains (S, Se, Te): First Principles Calculations Using Line Symmetry Groups
The atomic structure, electronic, phonon, and optical properties of chalcogen helical chains (S, Se, Te) were studied using line symmetry groups and DFT calculations. The whole possible range of torsion deformations (from 0° to 180°), as well as the range of axial deformations (from 0.6 to 1.6) were...
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| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2025-03-01
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| Series: | Nanomaterials |
| Subjects: | |
| Online Access: | https://www.mdpi.com/2079-4991/15/7/505 |
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