Algorithm to evaluate rate constants for polyatomic chemical reactions. I. Theory and computational details.

Javier González Xavier Giménez Josep Maria Bofill Algorithm to evaluate rate constants for polyatomic chemical reactions. I. Theory and computational details. 2102-2110 2007 28 Journal of Computational Chemistry 13 http://dx.doi.org/10.1002/jcc.20728 db/journals/jcc/jcc28.html#GonzalezGB07