Výsledky vyhledávání - "P. I. Vadash"

INDO study of the interaction of methanol with molybdates

Autor: A. P. Zeif, P. I. Vadash, B. I. Popov, V. D. Sutula

Publikováno v: Reaction Kinetics and Catalysis Letters. 9:79-83

The energy of interaction between a methanol molecule and an MoO42− group of the Fe2(MoO4)3 and Ga2(MoO4)3 lattice, and the force constant of the C−H bond calculated by the INDO method show that the deformation of MoO42− tetrahedra leading to t

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::c6962698ed6b7407d97098b1d9feb299
https://doi.org/10.1007/bf02070373

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Quantum-chemical studies of olefin activation on gallium oxide

Autor: V. D. Sokolovskii, P. I. Vadash, A. P. Zeif

Publikováno v: Reaction Kinetics and Catalysis Letters. 10:71-75

The interaction of propylene with gallium oxide has been studied by the MINDO-3 method using a cluster model. It is shown that the energy barrier against allyl C−H bond dissociation is mainly determined by the Coulomb repulsion between the molecule

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::1d5fdbec1a283371ef2556104668ce43
https://doi.org/10.1007/bf02067515

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