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Ab initio quantum chemistry methods
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21	RICE UNIVERSITY Linear Scaling Density Functional Theory with Gaussian Orbitals and Periodic Boundary Conditions by Add to Reading List Source URL: scuseria.rice.edu Language: English - Date: 2006-05-03 17:46:09 Quantum chemistry Atomic physics Crystal Numerical analysis Gaussian Density functional theory Ab initio quantum chemistry methods Basis set Fast multipole method Chemistry Theoretical chemistry Computational chemistry
22	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
23	Microsoft PowerPoint - 2011_02_14_FOS_Rodney_Bartlett.pptx Add to Reading List Source URL: computerlectures.pnnl.gov Language: English - Date: 2011-01-27 15:18:04 Physics Quantum mechanics Computational chemistry ACES University of Florida Rodney J. Bartlett Ab initio quantum chemistry methods Quantum chemistry Schrödinger equation Chemistry Theoretical chemistry Science
24	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
25	PDF Document Add to Reading List Source URL: tulane.edu Language: English - Date: 2011-05-31 10:47:49 Computational physics Computational chemistry Theoretical chemistry Density functional theory Ab initio quantum chemistry methods Pseudopotential Physical Review John Perdew Chemistry Physics Science
26	PDF Document Add to Reading List Source URL: www.kofo.mpg.de Language: English - Date: 2014-11-10 05:44:33 Theoretical chemistry Ab initio quantum chemistry methods Molecular physics MNDO Semi-empirical quantum chemistry method Density functional theory Molecular dynamics Force field NDDO Chemistry Computational chemistry Molecular modelling
27	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
28	Microsoft Word - F-BRIDGE - D221 - revision 0 - Assessment of atomistic modeling methods - v8 validated.doc Add to Reading List Source URL: www.f-bridge.eu Language: English - Date: 2013-04-23 06:24:59 Quantum chemistry Computational chemistry Density functional theory Atomic physics Hybrid functional Ab initio quantum chemistry methods Molecular dynamics Local-density approximation Jellium Chemistry Physics Theoretical chemistry
29	Microsoft Word - F-BRIDGE - D131 - revision 1 - Cluster Expansion Model for UPuC and UPuO - validated.doc Add to Reading List Source URL: www.f-bridge.eu Language: English - Date: 2013-04-23 06:25:45 Carcinogens Plutonium Carbide Chemical element Ab initio quantum chemistry methods Oxide Density functional theory Chemistry Anions Actinides
30	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

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