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Hartree
Results: 165

#	Item
41	Goldschmidt 2000 September 3rd–8th, 2000 Oxford, UK. Journal of Conference Abstracts Volume 5(2), 1017 Add to Reading List Source URL: www.the-conference.com Language: English - Date: 2009-11-05 06:01:14 Hartree–Fock method Enol Deprotonation Acid dissociation constant Silicate Chemistry Chemical reactions Protonation
42	f Solid State Physics Peter E. Blöchl Add to Reading List Source URL: orion.pt.tu-clausthal.de Language: English - Date: 2012-05-09 14:28:53 Computational chemistry Theoretical chemistry Atomic physics Chemical bonding Hartree–Fock method Atomic orbital Slater determinant Molecular orbital Spin contamination Chemistry Physics Quantum chemistry
43	Pure &App/. Chern., Vol. 70, No. 4, pp, 1998. Printed in Great BritainIUPAC INTERNATIONAL UNION OF PURE AND APPLIED CHEMISTRY Add to Reading List Source URL: old.iupac.org Language: English - Date: 2004-06-03 12:09:55 Quantum 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
44	PDF Document Add to Reading List Source URL: www.tcm.phy.cam.ac.uk Language: English - Date: 2015-05-23 17:30:42 Theoretical chemistry Computational chemistry Atomic physics Molecular physics Quantum Monte Carlo Hartree–Fock method Crystal Variational Monte Carlo Ab initio quantum chemistry methods Chemistry Physics Quantum chemistry
45	PUBLICATIONSB. Birknes and K. Fægri, jr. "Empirical Correlation of CNDO/2 and Extended Huckel Ionization Energies for the Azines." Acta. Chem. Scand. A29, , 1975. Add to Reading List Source URL: www.uio.no Language: English Hartree–Fock method Knut Fægri Ab initio quantum chemistry methods Dirac Møller–Plesset perturbation theory Chemistry Theoretical chemistry Computational chemistry
46	Mean-field limit for generic Bose gases: Hartree and Bogoliubov theories Add to Reading List Source URL: projects.au.dk Language: English - Date: 2013-04-29 03:33:46 Quantum mechanics Albert Einstein Bose–Einstein condensate Exotic matter Bose gas Physics Matter Condensed matter physics
47	View Online / Journal Homepage / Table of Contents for this issue Chem Soc Rev Dynamic Article Links Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2012-07-06 06:51:09 Computational chemistry Theoretical chemistry Quantum chemistry Matrix theory Matrices Matrix Hartree–Fock method Diagonalizable matrix Density functional theory Algebra Chemistry Linear algebra
48	THE JOURNAL OF CHEMICAL PHYSICS 134, Communication: Linear-expansion shooting techniques for accelerating self-consistent field convergence Yan Alexander Wang,1,a) Chi Yung Yam,2 Ya Kun Chen,1 and GuanHua Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2011-08-31 09:27:57 Numerical linear algebra Computational chemistry Computational physics DIIS Hartree–Fock method Matrix Chemistry Quantum chemistry Physics
49	SCIENCE CHINA Chemistry • REVIEWS • Progress of Projects Supported by NSFC · SPECIAL ISSUE · Chemical Methodology January 2014 Vol.57 No.1: 70–77 Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2015-04-22 02:25:20 Computational chemistry Theoretical chemistry Quantum chemistry Computational physics Atomic physics Time-dependent density functional theory Ab initio quantum chemistry methods Hartree–Fock method Density functional theory Chemistry Physics Science
50	Copyright © 2006 American Scientiﬁc Publishers All rights reserved Printed in the United States of America Journal of Computational and Theoretical Nanoscience Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:06 Density functional theory Computational chemistry Computational physics Quantum chemistry Theoretical chemistry Hybrid functional Hartree–Fock method Time-dependent density functional theory Crystal Chemistry Physics Quantum mechanics

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