Electronic Resource
College Park, Md.
:
American Institute of Physics (AIP)
The Journal of Chemical Physics
113 (2000), S. 6465-6468
ISSN:
1089-7690
Source:
AIP Digital Archive
Topics:
Physics
,
Chemistry and Pharmacology
Notes:
Ab initio molecular orbital theory is coupled with laser flash photolysis experiments to study the UV spectrum and absorption cross section of the methyl formate radical. The vertical excitation energies for four of methyl formate radical's excited states are calculated at the MRCI level of theory. In the region between 220 and 340 nm, two electronic transitions are identified to explain the experimental UV spectrum. © 2000 American Institute of Physics.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1063/1.1318741
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