Journal of Molecular Structure · 1975 · 10 citations · 12 references
Natural SciencesChemistryComputational ChemistryCrystal StructureAb Initio MethodsAtomistic ModelingEnergy MinimizationMolecular DynamicsPerturbation TheoryAb Initio CalculationsAb Initio Few-body CalculationsAb Initio Molecular CalculationsAb Initio SimulationsAb Initio Structure Solution
12
Gaussian basis sets for the first and second row atoms
B. Roos, Per E. M. Siegbahn · Theoretical Chemistry Accounts · 1970 · 497 citations
Natural Sciences, Chemistry, Physics +13
Microwave Spectra and Molecular Structures of Methyl Cyanide and Methyl Isocyanide
Myer Kessler, Harold Ring, R. Trambarulo et al. · Physical Review · 1950 · 183 citations
Natural Sciences, Chemistry, Physics +12
Ira N. Levine · The Journal of Chemical Physics · 1963 · 137 citations