Reactive Molecular Dynamics Simulation of Solid Nitromethane Impact on (010) Surfaces Induced and Nonimpact Thermal Decomposition
Author:
Affiliation:
1. Institute of Atomic and Molecular Physics and ‡School of Physical Science & Technology, Sichuan University, Chengdu, Sichuan Province, P. R. C.
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp211914e
Reference35 articles.
1. Raman and infrared investigations at room temperature of the internal modes behaviour in solid nitromethane-h3 and -d3 up to 45 GPa
2. Crystal Structure of Nitromethane up to the Reaction Threshold Pressure
3. Modeling the Decomposition of Nitromethane, Induced by Shock Heating
4. Phase transitions and chemical transformations of nitromethane up to 350 °C and 35 GPa
5. The structure of nitromethane at pressures of 0.3 to 6.0 GPa
Cited by 66 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. Initial Decomposition Mechanism of NH3OH+N5– Crystal under Thermal and Shock Loading: A First-Principles Study;The Journal of Physical Chemistry A;2024-03-07
2. Exploring the thermal decomposition and detonation mechanisms of 2,4-dinitroanisole by TG-FTIR-MS and molecular simulations;RSC Advances;2024
3. Determining the mechanical and decomposition properties of high energetic materials (α-RDX, β-HMX, and ε-CL-20) using a neural network potential;Physical Chemistry Chemical Physics;2024
4. Thermal decomposition mechanisms and stability of NTO crystal involving molecular vacancy and surface effects: DFTB-MD and DFT studies;Journal of Materials Science;2023-02
5. Triggering the mechanism of the initial reaction of energetic materials under pressure based on Raman intensity analysis;Physical Chemistry Chemical Physics;2023
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3