Interpolated algorithm for large-curvature tunneling calculations of transmission coefficients for variational transition state theory calculations of reaction rates

  1. Fernández-Ramos, A.
  2. Truhlar, D.G.
  3. Corchado, J.C.
  4. Espinosa-García, J.
Revista:
Journal of Physical Chemistry A

ISSN: 1089-5639

Ano de publicación: 2002

Volume: 106

Número: 19

Páxinas: 4957-4960

Tipo: Artigo

DOI: 10.1021/JP014204T GOOGLE SCHOLAR