Energetics of naphthynes — Performance of reduced multi-reference coupled-cluster methods for diradicals1

Author: Li Xiangzhu   Paldus Josef  

Publisher: NRC Research Press

ISSN: 1480-3291

Source: Canadian Journal of Chemistry, Vol.87, Iss.7, 2009-07, pp. : 917-926

Disclaimer: Any content in publications that violate the sovereignty, the constitution or regulations of the PRC is not accepted or approved by CNPIEC.

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Abstract