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Ab Initio
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171	JOURNAL OF CHEMICAL PHYSICS VOLUME 121, NUMBER[removed]OCTOBER 2004 Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2010-12-19 08:35:06 Computational chemistry Quantum chemistry Atomic physics Density functional theory Hybrid functional Hartree–Fock method Basis set Ab initio quantum chemistry methods Electronic correlation Chemistry Physics Theoretical chemistry
172	J. Phys. Chem. A XXXX, xxx, 000 A On the Construction of Diabatic and Adiabatic Potential Energy Surfaces Based on Ab Initio Valence Bond Theory† Add to Reading List Source URL: www.dtc.umn.edu Language: English - Date: 2012-08-16 12:29:06 Computational chemistry Chemical bonding Theoretical chemistry Quantum mechanics Diabatic Resonance Molecular orbital theory Valence bond theory Chemical bond Chemistry Physics Quantum chemistry
173	Ab Initio Phasing by Dual-Space Direct Methods Charles M. Weeks1, George M. Sheldrick2, Russ Miller1,3 , Isabel Usón2 and Herbert A. Hauptman1 1Hauptman-Woodward Medical Research Institute, Inc. 73 High Street, Buffalo Add to Reading List Source URL: www.hwi.buffalo.edu Language: English - Date: 2008-04-11 10:13:31 Science Phase problem Fourier transform Molecular replacement Patterson function Structure factor Fourier analysis Crystallography Mathematical analysis Physics
174	Chemical Physics[removed]–77 Contents lists available at ScienceDirect Chemical Physics journal homepage: www.elsevier.com/locate/chemphys Add to Reading List Source URL: yangtze.hku.hk Language: English - Date: 2012-07-06 05:48:56 Theoretical chemistry Quantum chemistry Time-dependent density functional theory Density functional theory Molecular Hamiltonian Electronic band structure Basis set Ab initio quantum chemistry methods Molecular dynamics Chemistry Physics Computational chemistry
175	Max Planck Institute of Microstructure Physics Theory Department Reduced density matrix functional theory: An ab-initio approach describing strong (and weak) correlations S. Sharma, J.K. Dewhurst, T. Baldsiefen, F. Eich, Add to Reading List Source URL: www2.mpi-halle.mpg.de Language: English - Date: 2013-06-11 04:58:23 Density functional theory Local-density approximation Philosophy of science
176	Faculté des Sciences Département d’Informatique Algorithme d’optimisation par colonie de fourmis : développement et application à la prédiction ab initio de Add to Reading List Source URL: www.cerkinfo.be Language: French - Date: 2008-08-19 07:42:03
177	HAKEMUS AB INITIO / AMMATTILENTÄJÄKOULUTUKSEEN PERUSTIEDOT TÄYTÄ TEKSTATEN Sukunimi (myös entinen) Add to Reading List Source URL: www.salpauslento.fi Language: Finnish - Date: 2010-10-05 11:22:04
178	International Baccalaureate Diploma Programme Subject Brief Language acquisition: Language ab initio – Standard level First assessments 2013 – Last assessments 2019 Add to Reading List Source URL: ibo.org Language: English - Date: 2014-09-22 12:06:02 IB Diploma Programme IB Group 2 subjects Overseas School of Colombo Education International Baccalaureate Evaluation
179	More quantum chemistry with BOINC Martin Korth Theory of Condensed Matter group, Cavendish Laboratory University of Cambridge The 6th BOINC Workshop — [removed] Add to Reading List Source URL: boinc.berkeley.edu Language: English - Date: 2010-09-02 04:26:29 Theoretical chemistry QM/MM Hartree–Fock method Ab initio quantum chemistry methods Density functional theory Quantum chemistry ONIOM Chemistry Computational chemistry Science
180	MANAGEMENT AND STRATEGY TRAINING WITHOUT BOUNDARIES Optimisation of training methods and facilities, and economy of scale, has considerably reduced the cost of training ab-initio ATC students Add to Reading List Source URL: www.entrypointnorth.com Language: English - Date: 2014-07-09 06:50:38

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