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Potential energy functions of the X?2B1, Ã2B2, B?2A1, and C?2A2 states of Cl2O+ and the X?1A1 state of Cl2O: Franck–Condon simulations of photoelectron bands of Cl2O which include anharmonicity

Potential energy functions of the X?2B1, Ã2B2, B?2A1, and C?2A2 states of Cl2O+ and the X?1A1 state of Cl2O: Franck–Condon simulations of photoelectron bands of Cl2O which include anharmonicity
Potential energy functions of the X?2B1, Ã2B2, B?2A1, and C?2A2 states of Cl2O+ and the X?1A1 state of Cl2O: Franck–Condon simulations of photoelectron bands of Cl2O which include anharmonicity
basis-set extrapolation, ab-initio calculations, spectrum
0021-9606
4025-4036
Chau, Foo-Tim
e15ec394-d11b-4cbe-91f3-cdac037d9d0e
Dyke, John M.
46393b45-6694-46f3-af20-d7369d26199f
Lee, Edmond P.F.
f47c6d5d-2d1f-4f03-a3ff-03658812d80b
Mok, Daniel Kam-Wah
49a4e516-0e71-4f59-a3ec-bd607b47ef33
Chau, Foo-Tim
e15ec394-d11b-4cbe-91f3-cdac037d9d0e
Dyke, John M.
46393b45-6694-46f3-af20-d7369d26199f
Lee, Edmond P.F.
f47c6d5d-2d1f-4f03-a3ff-03658812d80b
Mok, Daniel Kam-Wah
49a4e516-0e71-4f59-a3ec-bd607b47ef33

Chau, Foo-Tim, Dyke, John M., Lee, Edmond P.F. and Mok, Daniel Kam-Wah (2003) Potential energy functions of the X?2B1, Ã2B2, B?2A1, and C?2A2 states of Cl2O+ and the X?1A1 state of Cl2O: Franck–Condon simulations of photoelectron bands of Cl2O which include anharmonicity. The Journal of Chemical Physics, 118 (9), 4025-4036. (doi:10.1063/1.1554271).

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Published date: 1 March 2003
Keywords: basis-set extrapolation, ab-initio calculations, spectrum
Organisations: Chemistry

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Local EPrints ID: 19927
URI: https://eprints.soton.ac.uk/id/eprint/19927
ISSN: 0021-9606
PURE UUID: 596ea559-97b0-40c5-a0f1-ca1ad747a556
ORCID for John M. Dyke: ORCID iD orcid.org/0000-0002-9808-303X

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Date deposited: 23 Feb 2006
Last modified: 06 Jun 2018 13:16

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Contributors

Author: Foo-Tim Chau
Author: John M. Dyke ORCID iD
Author: Edmond P.F. Lee
Author: Daniel Kam-Wah Mok

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