Role of Interchain Interaction in Determining the Band Gap of Trigonal Selenium: A Density Functional Theory Study with a Linear Combination of Bloch Orbitals-Reference-Cited by-同舟云学术

Role of Interchain Interaction in Determining the Band Gap of Trigonal Selenium: A Density Functional Theory Study with a Linear Combination of Bloch Orbitals

Published:2014-08-06 Issue:33 Volume:118 Page:19294-19307
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Matsui Masafuyu¹

Affiliation:

1. Department of Chemistry, Graduate School of Science, Kyoto University, Kitashirakawa, Sakyo-ku, Kyoto 606-8502, Japan

Funder

Ministry of Education, Culture, Sports, Science, and Technology

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/jp5047084

Reference45 articles.

1. Structure and Electronic Properties of Te–Se Mixtures under High Pressure

2. Effect of pressure on the atom positions in Se and Te

3. Raman Scattering of Trigonal Se and Te at Very High Pressure

4. Geometry, Phase Stability, and Electronic Properties of Isolated Selenium Chains Incorporated in a Nanoporous Matrix

5. Electronic structure of trigonal and amorphous Se and Te

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