Adam Clay1, Kiril Datchev1, Wenlan Miao2

  • 1Purdue University, Department of Mathematics, West Lafayette, Indiana 47907, USA.

PubMed
概括

将密度函数计算标准化为电子计数是标准的,但违反这一点会提高准确性. 这项研究得出了规范化校正,增强了各种系统的能量计算.

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