Post-Hartree–Fock

Results: 3



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1Quantum chemistry / Ab initio quantum chemistry methods / International Union of Pure and Applied Chemistry / Hartree–Fock method / Force field / Post-Hartree–Fock / Basis set / MPEG-1 Audio Layer II / Quantum chemistry composite methods / Chemistry / Computational chemistry / Theoretical chemistry

Pure &App/. Chern., Vol. 70, No. 4, pp, 1998. Printed in Great BritainIUPAC INTERNATIONAL UNION OF PURE AND APPLIED CHEMISTRY

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Source URL: old.iupac.org

Language: English - Date: 2004-06-03 12:09:55
2Quantum chemistry / Atomic physics / Quadratic configuration interaction / Ab initio quantum chemistry methods / Hartree–Fock method / Post-Hartree–Fock / Gaussian / Density functional theory / Dirac / Chemistry / Computational chemistry / Theoretical chemistry

A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods Miquel Sola`, Jordi Mestres, Ramon Carbo´, and Miquel

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Source URL: dugi-doc.udg.edu

Language: English - Date: 2013-05-13 07:54:16
3Theoretical chemistry / Quantum chemistry / Post-Hartree–Fock / Molecular dynamics / Chemist / Hartree–Fock method / Ab initio quantum chemistry methods / Molecular modelling / Molecular orbital theory / Chemistry / Computational chemistry / Science

CHEM 4660: Computational Chemistry CHEM 7800 A01 Topics in Theoretical Chemistry: Computational Chemistry I Course Syllabus – 2014 Instructors Georg Schreckenbach Office: 552 Parker Building

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Source URL: home.cc.umanitoba.ca

Language: English - Date: 2014-07-09 08:40:24
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