Effect of the Spin-Orbit Interaction on the Thermodynamic Properties of Crystals: Specific Heat of Bismuth
- 19 October 2007
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review Letters
- Vol. 99 (16), 165504
- https://doi.org/10.1103/physrevlett.99.165504
Abstract
We discuss measurements and ab initio calculations of the specific heat for crystalline bismuth, strictly speaking, a semimetal but in the temperature region accessible to us () acting as a semiconductor. We extend experimental data available in the literature and notice that the ab initio calculations without spin-orbit interaction exhibit a maximum at , about 20% lower than the measured one. Inclusion of spin-orbit interaction decreases the discrepancy markedly: the maximum of is now only 7% larger than the measured one. Exact agreement is obtained if the strength of the spin-orbit Hamiltonian is reduced by a factor of . We also discuss the dependence of the lattice parameter and the cohesive energy on spin-orbit interaction.
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