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Efficacy of surface error corrections to density functional theory calculations of vacancy formation energy in transition metals

Efficacy of surface error corrections to density functional theory calculations of vacancy formation energy in transition metals

P. K. Nandi; M. C. Valsakumar; S. Chandra; H. K. Sahu; C. S. Sundar
  • 作者P. K. Nandi; M. C. Valsakumar; S. Chandra; H. K. Sahu; C. S. Sundar
  • 文件大小963.09KB
  • 发表时间2010
  • DOI10.1088/0953-8984/22/34/345501
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