Theoretical Chemistry Accounts

, Volume 111, Issue 1, pp 56–56

Accuracy of geometries: influence of basis set, exchange–correlation potential, inclusion of core electrons, and relativistic corrections


DOI: 10.1007/s00214-003-0564-x

Cite this article as:
Swart, M. & Snijders, J. Theor Chem Acc (2004) 111: 56. doi:10.1007/s00214-003-0564-x
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© Springer-Verlag Berlin Heidelberg 2003

Authors and Affiliations

  1. 1.Theoretische Chemie (MSC)Rijksuniversiteit GroningenAG GroningenThe Netherlands
  2. 2.Organische en Anorganische ChemieVrije Universiteit AmsterdamHV AmsterdamThe Netherlands

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