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

Addicoat, M.A. ORCID: 0000-0002-5406-7927 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:	Number Type 10.1063/1.3122542 DOI
Divisions:	Schools > School of Science and Technology
Record created by:	Jonathan Gallacher
Date Added:	16 May 2017 14:31
Last Modified:	27 May 2020 14:38
URI:	https://irep.ntu.ac.uk/id/eprint/30681

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