Hybrid ab initio Kohn-Sham density functional theory/frozen-density orbital-free density functional theory simulation method suitable for biological systems

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2008

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Hodak, M., Lu, W. C., & Bernholc, J. (2008). Hybrid ab initio Kohn-Sham density functional theory/frozen-density orbital-free density functional theory simulation method suitable for biological systems. Journal of chemical physics, 128(1).

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