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Ab initio potential energy surface and quantum dynamics for the H + CH4 → H2 + CH3 reaction

Yong Zhou1, Bina Fu, Chunrui Wang

  • 1State Key Laboratory of Molecular Reaction Dynamics and Center for Theoretical Computational Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, People's Republic of China.

The Journal of Chemical Physics
|February 17, 2011
PubMed

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