Ab initio and TDDFT study of the structural and spectroscopic properties of buckybowls: Corannulene and two methylcorannulenes

Journal of Molecular Structure: THEOCHEM

Volumn 859, Issue 1-3, 2008, Pages 107-112

  Tiwary, Amit S ^a   Mukherjee, Asok K ^b  

^a Netaji Mahavidyalaya ^*  (India)

^b UNIVERSITY OF BURDWAN   (India)

Author keywords

Buckybowl; Corannulene; IR; Methylated corannulenes; NMR; TDDFT

Indexed keywords

EID: 44049090555     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.03.015     Document Type: Article

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