A General Theory of Self-Consistent Field Beyond Hartree-Fock

Autor: Peng, Huan-wu
Zdroj: Communications in Theoretical Physics; September 1993, Vol. 20 Issue: 2 p239-242, 4p
Abstrakt: A general scheme is devised in the formalism of second quantization to make the Hamiltonian of an electronic system diagonal by a unitary transformation together with a suitable choice of the basis of one-electron wave functions. The scheme can be regarded as a generalization of the Hartree-Fock approximation of self-consistent field, and can be carried to any order of approximation in principle. Formulae for the lowest order approximation beyond Hartree-Fock are given.
Databáze: Supplemental Index