Mathematical methods in quantum chemistry. An introduction

DOI10.1007/3-540-37661-5zbMath1167.81001OpenAlexW1559952918MaRDI QIDQ2491951

Eric Cancès, Yvon Maday, Claude Le Bris

Publication date: 31 May 2006

Published in: Mathématiques \& Applications (Berlin) (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/3-540-37661-5

zbMATH Keywords

Schrödinger equationquantum mechanicsspindensity functional theoryThomas-Fermi modelquantum chemistryatomsHölder inequalitymoleculessolidsHardy inequalityHartree-Fock methodmany-electron systemsSlater determinantEuler-Lagrange equations of motion\(N\)-representability problemAufbau principleFermi-Amaldi correction termKohn-Sham self-consistent field approachmany-body variational principleMøller-Plesset perturbation methodRoothaan methodSobolev-Gagliardo-Nirenberg inequalityThomas-Fermi-von Weizsäcker model

Mathematics Subject Classification ID

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