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- W3215929891 abstract "Studies of the dissociative chemisorption of N2 using two-dimensional empirical potential energy surfaces that differ by the position of the saddle point, all show high tunneling probabilities at energies well below the saddle-point energy of the reaction. This is highly unusual for a heavy-atom system and contradicted by one-dimensional analysis along the minimum-energy path. A mechanism of over-barrier crossing, related to the high-momentum tail of the vibrational wave function of N2, is demonstrated. We analyze the two-dimensional wave-packet propagation and compares to the probability of having vibrational momenta that exceeds the value required to overcome the relevant barrier." @default.
- W3215929891 created "2021-12-06" @default.
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- W3215929891 date "2021-11-01" @default.
- W3215929891 modified "2023-09-27" @default.
- W3215929891 title "Over-barrier crossing in multidimensional tunneling" @default.
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- W3215929891 doi "https://doi.org/10.1016/j.cplett.2021.139255" @default.
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