Improved LDA-1/2 method for band structure calculations in covalent semiconductors-Reference-Cited by-同舟云学术

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Improved LDA-1/2 method for band structure calculations in covalent semiconductors

Published:2018-10 Issue: Volume:153 Page:493-505
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

Xue Kan-Hao,Yuan Jun-Hui,Fonseca Leonardo R.C.,Miao Xiang-Shui

Funder

National Key Research and Development Program of China

National Natural Science Foundation of China

Fundamental Research Funds for the Central Universities of China

Hubei “Chu-Tian Young Scholar” program

Brazilian agency CNPq

Publisher

Elsevier BV

Subject

Computational Mathematics,General Physics and Astronomy,Mechanics of Materials,General Materials Science,General Chemistry,General Computer Science

Reference71 articles.

1. Inhomogeneous electron gas;Hohenberg;Phys. Rev.,1964

2. Density functional theory is straying from the path toward the exact functional;Medvedev;Science,2017

3. Self-consistent equations including exchange and correlation effects;Kohn;Phys. Rev.,1965

4. Electron correlation in semiconductors and insulators: band gaps and quasiparticle energies;Hybertsen;Phys. Rev. B.,1986

5. Ground state of the electron gas by a stochastic method;Ceperley;Phys. Rev. Lett.,1980

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