Parameter-free calculations of total energies, interatomic forces and vibrational entropies of defects in semiconductors

Author:

Scheffler Matthias,Dabrowski Jaroslaw

Publisher

Informa UK Limited

Subject

Metals and Alloys,Physics and Astronomy (miscellaneous),Condensed Matter Physics,General Materials Science,Electronic, Optical and Magnetic Materials

Reference34 articles.

1. Self-consistent calculations of the electronic structure for ideal Ga and As vacancies in GaAs

2. Pseudopotentials that work: From H to Pu

3. Bachelet, G. B., Jacucci, G., Car, R. and Parrinello, M. 1987.Proceedings of the Eighteenth International Conference on the Physics of Semiconductors, 801Singapore: World Scientific.

4. Self-Consistent Green's-Function Calculation of the Ideal Si Vacancy

5. Theory of Enhanced Migration of Interstitial Aluminum in Silicon

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