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Examine os métodos selecionados lado a lado; as linhas que diferem ficam destacadas.

DFT Dependente do Tempo×Método de Hartree-Fock×
ÁreaComputação quânticaComputação quântica
FamíliaMachine learningMachine learning
Ano de origem19841928
Autor originalErich Runge and Eberhard GrossDouglas Hartree and Vladimir Fock
TipoExcited state methodElectronic structure method
Fonte seminalRunge, E., Gross, E. K. (1984). Density-functional theory for time-dependent systems. Physical Review Letters, 52, 997–1000. DOI ↗Fock, V. (1930). Näherungsmethode zur Lösung des quantenmechanischen Mehrkörperproblems. Zeitschrift für Physik, 61, 126–148. link ↗
Outros nomesTDDFT, TDDFT/DFTHF, self-consistent field
Relacionados34
ResumoTime-Dependent Density Functional Theory (TDDFT) extends DFT to excited states and time-dependent phenomena. Formulated by Runge and Gross in 1984, TDDFT enables calculation of excitation energies, optical spectra, and charge-transfer processes with moderate computational cost, making it invaluable for photochemistry and materials science.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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ScholarGateComparar métodos: Time-Dependent DFT · Hartree-Fock Method. Recuperado em 2026-06-17 de https://scholargate.app/pt/compare