A complete active space self-consistent field (CASSCF) ab...

Physical Chemistry Chemical Physics 2000 Vol. 2; Iss. 24

A complete active space self-consistent field (CASSCF) ab initio study of phenol–N2: the properties of a weak hydrogen-bonded system in its S1 excited state

Watkins, Mark J., Müller-Dethlefs, Klaus, Cockett, Martin C. R.
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Volume:
2
Year:
2000
Language:
english
Journal:
Physical Chemistry Chemical Physics
DOI:
10.1039/b006952n
File:
PDF, 284 KB
english, 2000
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