A global fundamental invariant neural network potential energy surface and dynamics study of the hydroxyl radical and ammonia reaction

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Abstract
A global ground electronic state potential energy surface for the OH + NH 3 reaction is constructed. The PES accurately describes not only the hydrogen abstraction channel, but also the NH 2 OH formation channel.
Funding Information
  • National Natural Science Foundation of China (22288201)
  • National Natural Science Foundation of China (22573104)
  • Chinese Academy of Sciences (XDB0450202)
  • Chinese Academy of Sciences (XDB0970202)
  • Chinese Academy of Sciences (XDB0970203)
  • Liaoning Revitalization Talents Program (XLYC2203062)

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