Gaussian orbital

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11	Theoretical Study of Hydrogen Bonds Between Acetylene and Selected Proton Donor Systems ´ . VIBO ´ K,2 G. J. HALA ´ SZ,3 S. SUHAI4 Add to Reading List Source URL: adatbank.transindex.ro Language: English - Date: 2011-06-28 10:46:39 Quantum chemistry Møller–Plesset perturbation theory Hartree–Fock method Basis set superposition error MP2 MPEG-1 Audio Layer II Molecular orbital Gaussian Perturbation theory Chemistry Computational chemistry Theoretical chemistry
12	PDF Document Add to Reading List Source URL: cs.anu.edu.au Language: English - Date: 2008-09-30 19:59:42 Quantum chemistry Quantum mechanics Gaussian function Computational chemistry Theoretical chemistry Basis set Atomic orbital Schrödinger equation Integral Physics Chemistry Mathematical analysis
13	PDF Document Add to Reading List Source URL: cc-ipcp.icp.ac.ru Language: English - Date: 2001-04-12 08:51:14 Quantum chemistry MOPAC MNDO Semi-empirical quantum chemistry method PM3 Gaussian Basis set Electronic band structure Molecular orbital Chemistry Theoretical chemistry Computational chemistry