Multiconfigurational quantum chemistry: The CASPT2 method
Stefano Battaglia, Ignacio Fdez. Galván, Roland Lindh
Topics & Concepts
Hamiltonian (control theory)Computer scienceStatistical physicsTheoretical physicsPhysicsMathematicsMathematical optimizationSpectroscopy and Quantum Chemical StudiesAdvanced Chemical Physics StudiesPhotochemistry and Electron Transfer Studies