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Rotational, Spin-Orbit and Spin-Spin Interactions by an Improved Configuration Interaction Treatment: Predissociation Lifetimes of Excited Fine Structure Levels of OF

AutorLara Castells, María Pilar de ; Palmieri, P.; Mitrushchenkov, Alexander O.
Fecha de publicación2000
EditorCSIC - Instituto de Física Fundamental (IFF)
Citación40th Sanibel Symposium, Quantum Theory Project, Gainsville, University of Florida, USA
ResumenThe state specific predissociation of OH in its lowest excited state is investigated using time dependent propagation techniques. To improve the accuracy of potential energy curves, spin-orbit, spin-spin and rotational interactions required for the treatment, we have refined our CI techniques and used optimal orbitals for each one of the electronic states. The potential energy curves, the matrix elements, and the lifetimes of the rotational sublevels are compared to experimental and theoretical values using multichannel scattering theory.
URIhttp://hdl.handle.net/10261/98880
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