Comments on 'Effective Core Potentials' [M.Dolg, Modern Methods and Algorithms of Quantum Chemistry (Ed. by J.Grotendorst, John von Neumann Institute for Computing, J'ulich, NIC Series, Vol.1, ISBN 3-00-005618-1, pp.479-508, 2000)]

摘要

The recent paper of M.Dolg is discussed and his critical remarks with respectto the Generalized Relativistic Effective Core Potential (GRECP) method areshown to be incorrect. Some main features of GRECP are discussed as comparedwith the ``energy-consistent/adjusted'' pseudopotential and with theconventional shape-consistent RECP.