articleTheoretical Chemistry AccountsJan 22, 2007Closed access

Optimized accurate auxiliary basis sets for RI-MP2 and RI-CC2 calculations for the atoms Rb to Rn

AHArnim HellwegCHChristof HättigSHSebastian HöfenerWKWim Klopper

Ruhr University Bochum · Karlsruhe Institute of Technology

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Topics & keywords

Topics
Keywords
  • Basis set
  • Basis (linear algebra)
  • Gaussian
  • Perturbation theory (quantum mechanics)
  • Møller–Plesset perturbation theory
  • Chemistry
  • STO-nG basis sets
  • Valence (chemistry)
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