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Non-periodic finite-element formulation of Kohn–Sham density functional theory

Non-periodic finite-element formulation of Kohn–Sham density functional theory

Phanish Suryanarayana; Vikram Gavini; Thomas Blesgen; Kaushik Bhattacharya; Michael Ortiz
  • 作者Phanish Suryanarayana; Vikram Gavini; Thomas Blesgen; Kaushik Bhattacharya; Michael Ortiz
  • 卷第58卷
  • 期第2期
  • 印刷ISSN0022-5096
  • 文件大小720.39KB
  • 发表时间2010
  • DOI10.1016/j.jmps.2009.10.002
  • 页码256-280
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