Thermal expansion ofc-Si viaab initiomolecular dynamics
- 15 January 1990
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 41 (3) , 1680-1683
- https://doi.org/10.1103/physrevb.41.1680
Abstract
We show that thermodynamic properties of semiconductors are accessible to first-principles calculations and can be computed with good accuracy.Keywords
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