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• W2321530812 abstract "Acetylene cations [HCCH](+) produced in the A(2)Σ(g)(+) state by extreme ultraviolet (XUV) photoionization are investigated theoretically, based on a mixed quantum-classical approach. We show that the decay of the A(2)Σ(g)(+) state occurs via both ultrafast isomerization and nonradiative electronic relaxation. We find a time scale for hydrogen migration and electronic decay of about 60 fs, in good agreement with recent XUV-pump/XUV-probe time-resolved experiments on the same system [Phys. Rev. Lett. 105, 263002 (2010)]. Moreover, we predict an efficient vibrational energy redistribution mechanism that quickly transfers excess energy from the isomerization coordinates to slower modes in a few hundred femtoseconds, leading to a partial regeneration of acetylenelike conformations." @default.
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• W2321530812 date "2011-12-20" @default.
• W2321530812 modified "2023-10-16" @default.
• W2321530812 title "Ultrafast Dynamics of Photoionized Acetylene" @default.
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• W2321530812 doi "https://doi.org/10.1103/physrevlett.107.263002" @default.
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