Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Sergey Ya. Ishchenko"'
Autor:
Eugene M. Myshakin, V. M. Mamaev, Sergey Ya. Ishchenko, Igor P. Gloriozov, Vahan V. Simonyan, Yury A. Ustynyuk, Andrew V. Prisyajnyuk
Publikováno v:
Mendeleev Communications. 5:137-138
Quantum rate constant evaluations and kinetic isotope effects for the oxidative addition of CH 4 (and CD 4 ) to a bare Pd atom, calculated in terms of the Reaction Path Hamiltonian approximation, show quantum tunneling to play a very important role i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::aef8be0b0a7723761aeefa36e4833f84
https://doi.org/10.1070/mc1995v005n04abeh000494
https://doi.org/10.1070/mc1995v005n04abeh000494
Autor:
Yu. A. Ustynyuk, Viktor M. Mamaev, Eugene M. Myshakin, Igor P. Gloriozov, Vahan V. Simonyan, Andrew V. Prisyajnyuk, Sergey Ya. Ishchenko
Publikováno v:
Journal of the Chemical Society, Faraday Transactions. 91:3779
The potential-energy surface has been calculated for oxidative addition of methane to a bare Pd atom by the semiempirical LCAO MO SCF CNDO/S2 technque. Quantum rate constants and values of the kinetic isotope effect have been computed for both the gr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::955d6fbad8f8c6329755fff40b086ebc
https://doi.org/10.1039/ft9959103779
https://doi.org/10.1039/ft9959103779