Hartree-Fock

专有名词
中文释义

英文释义

专有名词
  1. Ellipsis of Hartree-Fock method. abbreviation,also,alt-of,attributive,ellipsis
    — There exists another approach to correct the DFT and its related Kohn-Sham Hamiltonian: the Koopmans’ theorem¹¹⁻²². The original Koopmans’ theorem only states that in Hartree-Fock, the first ionization energy is equal to the highest occupied orbital energy if the wave function relaxations are ignored.
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