Effects of spin contamination on estimating bond dissociation energies of polycyclic aromatic hydrocarbons

Publisher: John Wiley & Sons Inc

E-ISSN: 1097-461x|115|12|796-801

ISSN: 0020-7608

Source: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (ELECTRONIC), Vol.115, Iss.12, 2015-06, pp. : 796-801

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Abstract