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Gruber, Balázs, Czakó, Gábor:
Benchmarkab initiocharacterization of the abstraction and substitution pathways of the OH + CH4/C(2)H(6)reactions.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 22 (26).
pp. 14560-14569.
ISSN 1463-9076
(2020)
Papp, Dóra, Gruber, Balázs, Czakó, Gábor:
Detailed benchmark ab initio mapping of the potential energy surfaces of the X + C2H6 [X = F, Cl, Br, I] reactions.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 21 (1).
pp. 396-408.
ISSN 1463-9076
(2019)