Journal of Chemical Physics, Vol.102, No.14, 5733-5742, 1995
Excited-State Reaction Pathways for S-Cis Buta-1,3-Diene
Keywords:MOLECULAR-ORBITAL THEORY;2ND-ORDER PERTURBATION-THEORY;NON-ADIABATIC INTERACTIONS;POTENTIAL-ENERGY SURFACES;ABSORPTION-SPECTROSCOPY;UNIMOLECULAR DECAY;BASIS-SETS;BUTADIENE;DYNAMICS;CYCLOBUTENE