Masaki Mine

We don’t have enough information about this author to calculate their statistics. If you think this is an error let us know.
Learn More
We developed new model core potentials (MCPs) for s-block elements from Na to Ra, in which the outer core (n-1)s and (n-1)p electrons are treated explicitly together with the ns electrons. By adding suitable correlating functions, we demonstrated that the present MCP basis sets show excellent performance in describing the electronic structures of atoms and(More)
  • 1