| |
Please cite the following reference:
Ge-Qi Mao, Zhao-Yi Yan, Kan-Hao Xue, Zhengwei Ai, Shengxin Yang, Hanli Cui, Jun-Hui Yuan, Tian-Ling Ren, and Xiangshui Miao, "DFT-1/2 and shell DFT-1/2 methods: electronic structure calculation for semiconductors at LDA complexity", Journal of Physics: Condensed Matter 34, 403001 (2022).
For information and references for the Abacus code, please visit: https://abacus.ustc.edu.cn
| |