Molecular Physics · 1960 · 162 citations · 2 references
Natural SciencesChemistryPhysicsMolecular PhysicsQuantum MechanicsTheoretical ChemistryMolecular InteractionsMolecular Orbital TheoryMolecular Quantum MechanicsMolecular VibrationSpin-orbit CouplingVibrational StructureBendingLinear MoleculesRotational Energy LevelsRotational-vibrational CouplingSpin-orbit Coupling EffectsSpin-orbit SplittingSpin-orbital CouplingVibrational-rotational Coupling
The Renner theory of vibrational-electronic interaction in linear triatomic molecules in Π electronic states is extended to take account of coupling between an odd electron spin and the electron orbital angular momentum. Perturbation expressions for the splittings and shifts of energy levels are obtained on the assumption that the Renner splittings and the spin-orbit coupling energy are of the same order of magnitude, but less than the energy quantum of the bending vibrations.
2
Theory of the Renner effect in the NH<sub>2</sub>radical
John A. Pople, H. C. Longuet–Higgins · Molecular Physics · 1958 · 212 citations · Full text
Natural Sciences, Chemistry, Physics +17