Band structures of II-VI semiconductors using Gaussian basis functions with separableab initiopseudopotentials: Application to prediction of band offsets-Reference-Cited by-同舟云学术

Band structures of II-VI semiconductors using Gaussian basis functions with separableab initiopseudopotentials: Application to prediction of band offsets

Published:1996-01-15 Issue:3 Volume:53 Page:1377-1387
ISSN:0163-1829
Container-title:Physical Review B
language:en
Short-container-title:Phys. Rev. B

Author:

Chen Xiaojie,Hua Xinlei,Hu Jinsong,Langlois Jean-Marc,Goddard William A.

Publisher

American Physical Society (APS)

Link

http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.53.1377/fulltext

Reference34 articles.

1. Dual-space approach for density-functional calculations of two- and three-dimensional crystals using Gaussian basis functions

2. First principles studies of band offsets at heterojunctions and of surface reconstruction using Gaussian dual-space density functional theory

3. Pseudopotentials that work: From H to Pu

4. Efficient recursive computation of molecular integrals over Cartesian Gaussian functions

5. Momentum-space formalism for the total energy of solids

Cited by 45 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. First-principles calculations to investigate electronic structure and optical spectra of CdxZn1-xS ternary semiconductor alloys;Chemical Physics Impact;2023-06

2. Electronic structure of short-period ZnSe/ZnTe superlattices based on DFT calculations;Condensed Matter Physics;2022

3. Prediction of electronic and optical properties for Zn1-xCdxSeyTe1-y quaternary alloys: First-principles study;Revista Mexicana de Física;2021-07-02

4. Computational study of structural, electronic, magnetic and optical properties of (ZnTe)m/(MnTe)n superlattices;Journal of Magnetism and Magnetic Materials;2020-04

5. First-principles study of the structural, electronic and optical properties of the cubic triangular quaternary ZnxCdyHg1-x-yTe alloys under hydrostatic pressure;Chinese Journal of Physics;2019-06