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Benchmark correlation energies for small molecules 

Authors: Darragh P. O'eill a; Peter M. W. Gill a
Affiliation:   a School of Chemistry, University of Nottingham, Nottingham NG7 2RD, UK
DOI: 10.1080/00268970512331339323
Publication Frequency: 24 issues per year
Published in: journal Molecular Physics, Volume 103, Issue 6 - 8 March 2005 , pages 763 - 766
Number of References: 28
Formats available: HTML (English) : PDF (English)
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Abstract

We present estimates of the exact correlation energies for 56 small molecules whose experimental atomization energies are known accurately. These should prove useful in the assessment and parameterization of new quantum chemical methods.
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