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The effect of external forces on the initial dissociation of RDX (1,3,5-trinitro-1,3,5-triazine): A mechanochemical study

  • Published:2017-07-07 Issue:20 Volume:117 Page:e25426
  • ISSN:0020-7608
  • Container-title:International Journal of Quantum Chemistry
  • language:en
  • Short-container-title:Int J Quantum Chem

Author:

Todde Guido1ORCID,Jha Sanjiv K.1ORCID,Subramanian Gopinath1

Affiliation:

1. School of Polymers and High Performance Materials; University of Southern Mississippi; Hattiesburg Mississippi 39406

Funder

USM

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Cited by 7 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. A Generalized Force-Modified Potential Energy Surface (G-FMPES) for Mechanochemical Simulations;Challenges and Advances in Computational Chemistry and Physics;2023-10-19

2. Modeling Molecules under Pressure with Gaussian Potentials;Journal of Chemical Theory and Computation;2020-12-22

3. A mechanochemical model for the simulation of molecules and molecular crystals under hydrostatic pressure;The Journal of Chemical Physics;2020-10-07

4. Molecular reaction dynamics simulation of thermal decomposition for aluminiferous RDX composites;Computational Materials Science;2020-05

5. Quantum chemical modeling of molecules under pressure;International Journal of Quantum Chemistry;2020-03-13
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