Predicted detonation properties at the Chapman-Jouguet state for proposed energetic materials (MTO and MTO3N) from combined ReaxFF and quantum mechanics reactive dynamics
- Tingting Zhou
- , Sergey V. Zybin
- , William A. Goddard
- , Tao Cheng
- , Saber Naserifar
- , Andres Jaramillo-Botero
- , Fenglei Huang
- IAPCM
- California Institute of Technology
- Beijing Institute of Technology
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