Explosion Study of Nitromethane Confined in Carbon Nanotube Nanocontainer via Reactive Molecular Dynamics
Author:
Affiliation:
1. School of Energy and Chemical Engineering, Ulsan National Institute of Science and Technology (UNIST), Ulsan 44919, Republic of Korea
2. Agency for Defense Development (ADD), P. O. Box 35, Yuseong, Daejeon 305-600, Republic of Korea
Funder
National Research Foundation of Korea
Agency for Defense Development
Publisher
American Chemical Society (ACS)
Subject
Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.6b11757
Reference43 articles.
1. Ultrafast Photodissociation Dynamics of Nitromethane
2. Theoretical Study of the CH3NO2 Unimolecular Decomposition Potential Energy Surface
3. Early chemistry in hot and dense nitromethane: Molecular dynamics simulations
4. Thermal Decomposition of the Solid Phase of Nitromethane:Ab InitioMolecular Dynamics Simulations
5. Thermal Decomposition of Condensed-Phase Nitromethane from Molecular Dynamics from ReaxFF Reactive Dynamics
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