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- W2276001021 abstract "The mode-specific dynamics for the dissociative chemisorption of H<sub>2</sub>O on Cu(111) is first investigated by seven-dimensional quantum dynamics calculations, based on an accurately fitted potential energy surface (PES) recently developed by neural network fitting to DFT energy points." @default.
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- W2276001021 date "2016-01-01" @default.
- W2276001021 modified "2023-09-30" @default.
- W2276001021 title "Mode specificity for the dissociative chemisorption of H<sub>2</sub>O on Cu(111): a quantum dynamics study on an accurately fitted potential energy surface" @default.
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- W2276001021 doi "https://doi.org/10.1039/c6cp00034g" @default.
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