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- W2775573246 abstract "A new global potential energy surface of the O<sup>+</sup> + H<sub>2</sub> system was constructed with neural network method, using about 63000 <italic>ab initio</italic> points, which were calculated by employing the multi-reference configuration interaction method with aug-cc-pVTZ and aug-cc-pVQZ basis sets." @default.
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- W2775573246 date "2018-01-01" @default.
- W2775573246 modified "2023-10-03" @default.
- W2775573246 title "A new potential energy surface of the OH<sub>2</sub><sup>+</sup> system and state-to-state quantum dynamics studies of the O<sup>+</sup> + H<sub>2</sub> reaction" @default.
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- W2775573246 doi "https://doi.org/10.1039/c7cp03676k" @default.
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