Theoretical studies of CN+H2(D2) reactions: competition between H(D)-abstractions in H(D) plus HCN(DCN)/HNC(DNC) channels

Albernaz, AF; Barreto, PRP

Albernaz, AF (reprint author), Univ Brasilia, Inst Fis, CP04455, BR-70919970 Brasilia, DF, Brazil.

THEORETICAL CHEMISTRY ACCOUNTS, 2019; 138 (7):

Abstract

The CN+H2 reaction was investigated by considering the two possible channels, H+HCN and H+HNC, taking into account the isotopic effects and with the v......

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