articleJournal of Molecular Structure THEOCHEMApr 1, 2002Closed access

Segmented contraction scheme for small-core lanthanide pseudopotential basis sets

XCXiaoyan CaoMDMichael Dolg

University of Bonn · Sun Yat-sen University

Indexed incrossref

Abstract

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878
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FWCI
4.10
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100%
References
54
Citations per year

Authors

2

Topics & keywords

Topics
Keywords
  • Pseudopotential
  • Lutetium
  • Lanthanide
  • Gaussian
  • Valence (chemistry)
  • Extrapolation
  • Density functional theory
  • Physics
UN Sustainable Development Goals
  • Affordable and clean energy
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