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Coupled Cluster CCSD×Hartree-Fock (HF) 방법×
분야양자컴퓨팅양자컴퓨팅
계열Machine learningMachine learning
기원 연도19661928
창시자Jiri CizekDouglas Hartree and Vladimir Fock
유형Electronic correlation methodElectronic structure method
원전Cizek, J. (1966). On the correlation problem in atomic and molecular systems. Journal of Chemical Physics, 45, 4256–4266. link ↗Fock, V. (1930). Näherungsmethode zur Lösung des quantenmechanischen Mehrkörperproblems. Zeitschrift für Physik, 61, 126–148. link ↗
별칭CCSD, CCSD(T)HF, self-consistent field
관련34
요약Coupled 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.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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ScholarGate방법 비교: Coupled Cluster CCSD · Hartree-Fock Method. 2026-06-17에 다음에서 검색함: https://scholargate.app/ko/compare