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- W2011756474 abstract "A systematic diatomic-in-molecules procedure is applied to the H3− system to calculate the potential energy surfaces of the ground and low-lying excited states over the full range of geometric configurations. The approach provides the correct behavior of the calculated potentials. A conical intersection of the ground-state and first excited-state surfaces is found in the D3h configuration. A detachment mechanism in H− + H2 collisions related to nonadiabatic transitions between the ground and first excited states is proposed and discussed." @default.
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- W2011756474 date "1997-07-01" @default.
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- W2011756474 title "Diatomics-in-molecules study of the ground and excited states of H3−" @default.
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- W2011756474 doi "https://doi.org/10.1016/s0301-0104(97)00134-1" @default.
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