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KSSOLV 2.0: An efficient MATLAB toolbox for solving the Kohn-Sham equations with plane-wave basis set.

Shizhe JiaoZhenlin ZhangKai WuLingyun WanHuanhuan MaJielan LiSheng ChenXinming QinJie LiuZijing DingJinlong YangYingzhou LiWei HuLin LinChao Yang
Published in: Comput. Phys. Commun. (2022)
Keyphrases
  • small number
  • database
  • neural network
  • three dimensional
  • probability distribution
  • user defined