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- W1540778158 abstract "The role of van der Waals forces in O(P3)+H2(υ=1,j=0) collisions is investigated theoretically at low and ultralow temperatures. Quantum scattering calculations have been performed for zero total angular momentum using the lowest London-Eyring-Polanyi-Sato double-polynomial A″3 potential-energy surface reported by [Rogers et al., J. Phys. Chem. A 104, 2308 (2000)] and its recent BMS1 and BMS2 extensions developed by [Brandão et al., J. Chem. Phys. 121, 8861 (2004)] which provide a more accurate treatment of the van der Waals interaction. Our calculations show that van der Waals forces strongly influence chemical reactivity at ultracold translational energies. The presence of a zero-energy resonance for the BMS1 surface is found to enhance reactivity in the ultracold regime and shift the Wigner threshold to lower temperatures." @default.
- W1540778158 created "2016-06-24" @default.
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- W1540778158 date "2005-10-08" @default.
- W1540778158 modified "2023-10-17" @default.
- W1540778158 title "Reactivity enhancement of ultracold O(P3)+H2 collisions by van der Waals interactions" @default.
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- W1540778158 doi "https://doi.org/10.1063/1.2060710" @default.
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