Concepedia
Chemical Physics Letters · 1996 · 34 citations · 10 references
Natural SciencesChemistryPhysical ChemistryLipid PeroxidationOxidation ReactionsRadical ReactionsRedox CatalysisRedox ChemistryRedox ReactionsHydrogen Abstraction Reactions
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A complete basis set model chemistry. V. Extensions to six or more heavy atoms
Joseph W. Ochterski, George A. Petersson, John A. Montgomery · The Journal of Chemical Physics · 1996 · 1.6K citations
Natural Sciences, Chemistry, Physics +17
A complete basis set model chemistry. IV. An improved atomic pair natural orbital method
John A. Montgomery, Joseph W. Ochterski, George A. Petersson · The Journal of Chemical Physics · 1994 · 780 citations · Full text
Natural Sciences, Chemistry, Computational Chemistry +11
Modification of the<scp>g</scp><scp>a</scp><scp>u</scp><scp>s</scp><scp>s</scp><scp>i</scp><scp>a</scp><scp>n</scp><scp>−</scp><scp>2</scp>theoretical model: The use of coupled-cluster energies, density-functional geometries, and frequencies
Alexander M. Mebel, Keiji Morokuma, M. C. Lin · The Journal of Chemical Physics · 1995 · 467 citations
Natural Sciences, Chemistry, Computational Chemistry +16
The sensitivity of B3LYP atomization energies to the basis set and a comparison of basis set requirements for CCSD(T) and B3LYP
Charles W. Bauschlicher, Harry Partridge · Chemical Physics Letters · 1995 · 296 citations
Natural Sciences, Chemistry, Physics +15
The enthalpy of formation of trioxy radicals ROOO (R H, CH3, C2H5). An ab initio study
T. P. W. Jungkamp, John H. Seinfeld · Chemical Physics Letters · 1996 · 80 citations
Natural Sciences, Biochemistry, Chemistry +16