Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5384630 | Chemical Physics Letters | 2011 | 5 Pages |
Abstract
⺠High level ab initio study of no pair bond in copper. ⺠CCSD(T) benchmark confirming the bonding nature of the state. ⺠Analysis of the basis set effect. ⺠Analysis of the core correlation effect. ⺠Analysis of the BSSE effect. ⺠Comparison with alkali metal no pair bond clusters.
Related Topics
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Chemistry
Physical and Theoretical Chemistry
Authors
Marco Verdicchio, Stefano Evangelisti, Thierry Leininger, José Sánchez-MarÃn, Antonio Monari,