Philosophical Transactions of the Royal Society of London Series A Mathematical and Physical Sciences · 1953 · 741 citations · 1 references
Natural SciencesChemistryPhysicsCondensed Matter PhysicsMolecular PhysicsQuantum ChemistryAb Initio MethodsMolecular Energy LevelsMolecular Orbital TheoryMolecular Quantum MechanicsMolecular StructureMolecular SymmetryElectronic Structure DeterminationElectronic Structure Of MoleculesHydrogen Atom Wave FunctionsMolecular Orbital AnalysisMolecular WavefunctionsVibrational Wave Functions
Abstract The 1 ^ , 2s(?g, 3 s(Tg,2p<xu, 3 pcru,4:pcru, 3dcrg, 4fcru, 2pnu and Sdng states of the hydrogen molecular ion are investigated. The main results are given in the form of tables of parameters from which the electronic wave functions (in spheroidal co-ordinates) can be obtained. A representative selection of contour diagrams is also presented.
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The Oscillator Strength of H2+, 1<i>s</i>σ—2<i>p</i>σ
D. R. Bates · The Journal of Chemical Physics · 1951 · 148 citations · Full text