Cumulative isomerization probability studied by various transition state wave packet methods including the MCTDH algorithm. Benchmark: HCN→CNH isomerization
Lasorne, B., Gatti, F., Baloitcha, E., Meyer, H.-D., Desouter-Lecomte, M.Volume:
121
Year:
2004
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.1760713
File:
PDF, 578 KB
english, 2004