Concepedia
Chemical Physics · 2008 · 51 citations · 50 references
Natural SciencesChemistryPhysicsComputational ChemistryTheoretical ChemistryTheoretical PhysicsAb Initio MethodsDensity Functional TheoryMolecular Orbital TheoryRelaxation MechanismsBasis Set Effects
50
Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
Thom H. Dunning · The Journal of Chemical Physics · 1989 · 31.7K citations
Natural Sciences, Chemistry, Physics +17
Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functions
Rick A. Kendall, Thom H. Dunning, Robert J. Harrison · The Journal of Chemical Physics · 1992 · 15.5K citations
On the eigenfunctions of many‐particle systems in quantum mechanics
Tosio Kato · Communications on Pure and Applied Mathematics · 1957 · 2K citations
Natural Sciences, Physics, Mathematical Physics +13
Accurate correlation consistent basis sets for molecular core–valence correlation effects: The second row atoms Al–Ar, and the first row atoms B–Ne revisited
Kirk A. Peterson, Thom H. Dunning · The Journal of Chemical Physics · 2002 · 2K citations
A simple and efficient CCSD(T)-F12 approximation
Thomas B. Adler, Gerald Knizia, Hans‐Joachim Werner · The Journal of Chemical Physics · 2007 · 2K citations
Natural Sciences, Chemistry, Physics +7