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Test of variational transition state theory and multidimensional semiclassical transmission coefficients methods against accurate quantal rate constants for H + H2/HD, D + H2, and O + H2/D2/HD, including intra- and intermolecular kinetic isotope effects
Garrett, Bruce C., Truhlar, Donald G., Schatz, George C.Volume:
108
Language:
english
Journal:
Journal of the American Chemical Society
DOI:
10.1021/ja00271a015
Date:
May, 1986
File:
PDF, 807 KB
english, 1986