Title of article
A diagonal orbital-invariant explicitly-correlated coupled-cluster method
Author/Authors
Tew، نويسنده , , David P. and Klopper، نويسنده , , Wim and Hنttig، نويسنده , , Christof، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2008
Pages
7
From page
326
To page
332
Abstract
We present an orbital-invariant explicitly-correlated coupled-cluster method where we determine the contribution from the geminal pair functions by the known first-order electron coalescence conditions. This method is free from geminal basis set superposition errors and yields quintuple- ζ quality correlation energies using triple- ζ orbital basis sets.
Journal title
Chemical Physics Letters
Serial Year
2008
Journal title
Chemical Physics Letters
Record number
1923540
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