articleChemical PhysicsNov 9, 2004Closed access

Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac–Hartree–Fock data

DFDetlev FiggenGRGuntram RauhutMDMichael DolgHSHermann Stoll

University of Stuttgart · University of Cologne

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Topics & keywords

Topics
Keywords
  • Chemistry
  • Atomic physics
  • Excited state
  • Valence (chemistry)
  • Configuration interaction
  • Excitation
  • Relativistic quantum chemistry
  • Valence electron
UN Sustainable Development Goals
  • Affordable and clean energy
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