1. See for instance:Dolg, M.InModern Methods and Algorithms of Quantum Chemistry, Proceedings,2nded.Grotendorst, J., Ed.John von Neumann Institute for Computing:Jülich, Germany, 2000; NIC Series Vol.3, pp507−540;www.fz-juelich.de/nic-series/Volume3/dolg.pdfand the extensive bibliography cited therein.
2. E.g.Frenking, G.; Antes, I.; Böhme, M.; Dapprich, S.; Ehlers, A. W.; Jonas, V.; Neuhaus, A.; Otto, M.; Stegmann, R.; Veldkamp, A.; Vyboishchikov, S. F.InReviews in Computational Chemistry;Lipkowitz, K. B., Boyd, D. B., Eds.VCH Publishers:New York, 1996; Vol.8, pp 63−144
3. Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals
4. Energy‐adjustedabinitiopseudopotentials for the first row transition elements
5. The prediction of molecular equilibrium structures by the standard electronic wave functions