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High-Throughput Computational Screening of Two-Dimensional Semiconductors

Description/Abstract:

By performing high-throughput first-principles calculations combined with a semiempirical van der Waals dispersion correction, we have sc...

Keyword:

2D Materials and DFT

Resource Type:

Article

Author:

Vei Wang, Gang Tang, Ya-Chao Liu, Ren-Tao Wang, Hiroshi Mizuseki, Yoshiyuki Kawazoe, Jun Nara, and Wen Tong Geng

Journal:

Journal of Physical Chemistry Letters

Date Uploaded:

25/12/2023