Excited states of Nb3N2 and Nb3C2: density functional theory, CASSCF, and MRCI studies

Addicoat, M.A. and Metha, G.F., 2009. Excited states of Nb3N2 and Nb3C2: density functional theory, CASSCF, and MRCI studies. The Journal of Chemical Physics, 130 (16), p. 164308. ISSN 0021-9606

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Item Type: Journal article
Publication Title: The Journal of Chemical Physics
Creators: Addicoat, M.A. and Metha, G.F.
Publisher: AIP Publishing
Date: April 2009
Volume: 130
Number: 16
ISSN: 0021-9606
Identifiers:
NumberType
10.1063/1.3122542DOI
Divisions: Schools > School of Science and Technology
Depositing User: Jonathan Gallacher
Date Added: 16 May 2017 14:31
Last Modified: 16 May 2017 14:31
URI: http://irep.ntu.ac.uk/id/eprint/30681

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