Symmetry breaking in molecular calculations and the...

Symmetry breaking in molecular calculations and the reliable prediction of equilibrium geometries. The formyloxyl radical as an example

McLean, A. D., Lengsfield, B. H., Pacansky, J., Ellinger, Y.
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Volume:
83
Year:
1985
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.449162
File:
PDF, 1.01 MB
english, 1985
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