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most citedCharged particle identification with the liquid xenon calorimeter of the CMD-3 detector

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physics.chem-ph2021

Quantum Monte Carlo Investigation of the H-transfer Reaction of Criegee Intermediate CH3CHOO: A Benchmark Calculation

Zhiping Wang, Yuxiang Bu

We perform the fixed-node diffuse Monte Carlo (FN DMC) calculations to determine the barrier height and reaction energy of a critical reaction, the H-transfer reaction from syn-CH3…