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نظریه اختلال مولر-پلسِت×کلاستر جفتی CCSD×
حوزهمحاسبات کوانتومیمحاسبات کوانتومی
خانوادهMachine learningMachine learning
سال پیدایش19341966
پدیدآورChristian Möller and Milton PlessetJiri Cizek
نوعPost-Hartree-Fock methodElectronic correlation method
منبع بنیادینMöller, C., Plesset, M. S. (1934). Note on an approximation treatment for many-electron systems. Physical Review, 46, 618–622. link ↗Cizek, J. (1966). On the correlation problem in atomic and molecular systems. Journal of Chemical Physics, 45, 4256–4266. link ↗
نام‌های دیگرMP2, MP3, MP4CCSD, CCSD(T)
مرتبط33
خلاصهMöller-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.Coupled Cluster theory, particularly CCSD (Singles and Doubles) and CCSD(T) with perturbative triples, is one of the most accurate methods for molecular electronic structure. Developed by Jiri Cizek in 1966, CC theory treats the ground state wave function as an exponential of excitation operators applied to the Hartree-Fock reference, enabling systematic treatment of electron correlation with guaranteed size consistency.
ScholarGateمجموعه‌داده
  1. v1
  2. 3 منابع
  3. PUBLISHED
  1. v1
  2. 3 منابع
  3. PUBLISHED

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ScholarGateمقایسهٔ روش‌ها: Moller-Plesset Perturbation Theory · Coupled Cluster CCSD. بازیابی‌شده در 2026-06-19 از https://scholargate.app/fa/compare