Complex Absorbing Potential Equation-of-Motion Coupled-Cluster Method Yields Smooth and Internally Consistent Potential Energy Surfaces and Lifetimes for Molecular Resonances.
Department of Chemistry, University of Southern California, Los Angeles, California 90089-0482, United States.
Thomas-C
TC
Jagau
Department of Chemistry, University of Southern California, Los Angeles, California 90089-0482, United States.
Anna I
AI
Krylov
coupled-cluster methods; equation-of-motion; metastable states; potential energy surfaces; resonances; transient anions