Molecular Dynamics Study on the Reaction of RDX Molecule with Si Substrate-Reference-Cited by-同舟云学术

Molecular Dynamics Study on the Reaction of RDX Molecule with Si Substrate

Published:2023-01-19 Issue:4 Volume:8 Page:4270-4277
ISSN:2470-1343
Container-title:ACS Omega
language:en
Short-container-title:ACS Omega

Author:

Xu Wei-Sen¹²^ORCID,Zhu Jing²,Hu Yan-Fei³,Ji Guang-Fu²

Affiliation:

1. Department of Engineering Mechanics, University of Science and Technology of China, Hefei 230026, Anhui, P. R. China

2. Institute of Fluid Physics, China Academy of Engineering Physics, Mianyang 621900, P. R. China

3. Department of Applied Physics, Chengdu University of Technology, Chengdu 610059, P. R. China

Funder

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Subject

General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acsomega.2c07512

Reference32 articles.

1. The phase diagram of rdx (hexahydro-1,3,5-trinitro-s-triazine) under hydrostatic pressure

2. Effects of pressure on the thermal decomposition kinetics, chemical reactivity and phase behavior of RDX

3. Intermolecular Potential for the Hexahydro-1,3,5-trinitro-1,3,5-s-triazine Crystal (RDX): A Crystal Packing, Monte Carlo, and Molecular Dynamics Study

4. Miller, G. R.; Garroway, A. N. A Review of the Crystal Structures of Common Explosives. Part I: RDX, HMX, TNT, PETN, and Tetryl, No. NRL/MR/6120-01-8585; Naval Research Lab: Washington DC; 2001.

5. Reinvestigation of the Gas-Phase Structure of RDX Using Density Functional Theory Predictions of Electron-Scattering Intensities

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