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Teoria e Perturbimit Moller-Plesset×Metoda Hartree-Fock×
FushaLlogaritja kuantikeLlogaritja kuantike
FamiljaMachine learningMachine learning
Viti i origjinës19341928
KrijuesiChristian Möller and Milton PlessetDouglas Hartree and Vladimir Fock
LlojiPost-Hartree-Fock methodElectronic structure method
Burimi themeluesMöller, C., Plesset, M. S. (1934). Note on an approximation treatment for many-electron systems. Physical Review, 46, 618–622. link ↗Fock, V. (1930). Näherungsmethode zur Lösung des quantenmechanischen Mehrkörperproblems. Zeitschrift für Physik, 61, 126–148. link ↗
Emërtime të tjeraMP2, MP3, MP4HF, self-consistent field
Të lidhura34
PërmbledhjaMöller-Plesset perturbation theory is a post-Hartree-Fock method that systematically corrects the HF reference by treating electron correlation as a perturbation. Introduced in 1934, MP theory provides increasingly accurate energy estimates (MP2, MP3, MP4, ...) by expanding the correlation energy in orders of perturbation.The Hartree-Fock (HF) method is a foundational self-consistent field approach for solving the many-electron Schrödinger equation. Developed independently by Douglas Hartree and Vladimir Fock in the late 1920s, it approximates the ground state by assuming electrons move in an average field generated by all other electrons, enabling tractable quantum chemistry calculations.
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ScholarGateKrahasoni metodat: Moller-Plesset Perturbation Theory · Hartree-Fock Method. Marrë më 2026-06-19 nga https://scholargate.app/sq/compare