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Functional derivatives of meta-generalized gradient approximation (meta-GGA) type exchange-correlation density functionals
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10.1063/1.4811270
/content/aip/journal/jcp/138/24/10.1063/1.4811270
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/24/10.1063/1.4811270
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Table I.

TDDFT excitations (in eV) of CO computed by different density functionals and the 6-311G(3df, 3pd) basis set compared with the experimental values. The leftmost column identifies the excitations by their symmetry labels.

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/content/aip/journal/jcp/138/24/10.1063/1.4811270
2013-06-27
2014-04-21
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Functional derivatives of meta-generalized gradient approximation (meta-GGA) type exchange-correlation density functionals
http://aip.metastore.ingenta.com/content/aip/journal/jcp/138/24/10.1063/1.4811270
10.1063/1.4811270
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