Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
American Chemical Society
2024-03-01
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| Series: | JACS Au |
| Online Access: | https://doi.org/10.1021/jacsau.4c00069 |
| _version_ | 1797198599179730944 |
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| author | Dezhou Guo Yuanyuan Wei Sergey V. Zybin Yan Liu Fenglei Huang William A. Goddard |
| author_facet | Dezhou Guo Yuanyuan Wei Sergey V. Zybin Yan Liu Fenglei Huang William A. Goddard |
| author_sort | Dezhou Guo |
| collection | DOAJ |
| first_indexed | 2024-04-24T07:02:25Z |
| format | Article |
| id | doaj.art-c98c8fbbca154d74ab3db58197018b7e |
| institution | Directory Open Access Journal |
| issn | 2691-3704 |
| language | English |
| last_indexed | 2024-04-24T07:02:25Z |
| publishDate | 2024-03-01 |
| publisher | American Chemical Society |
| record_format | Article |
| series | JACS Au |
| spelling | doaj.art-c98c8fbbca154d74ab3db58197018b7e2024-04-22T07:39:49ZengAmerican Chemical SocietyJACS Au2691-37042024-03-01441605161410.1021/jacsau.4c00069Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics SimulationsDezhou Guo0Yuanyuan Wei1Sergey V. Zybin2Yan Liu3Fenglei Huang4William A. Goddard5State Key Laboratory of Explosion Science and Technology, Beijing Institute of Technology, Beijing, People’s Republic of ChinaState Key Laboratory of Explosion Science and Technology, Beijing Institute of Technology, Beijing, People’s Republic of ChinaMaterials and Process Simulation Center, California Institute of Technology, Pasadena, California, United StatesState Key Laboratory of Explosion Science and Technology, Beijing Institute of Technology, Beijing, People’s Republic of ChinaState Key Laboratory of Explosion Science and Technology, Beijing Institute of Technology, Beijing, People’s Republic of ChinaMaterials and Process Simulation Center, California Institute of Technology, Pasadena, California, United Stateshttps://doi.org/10.1021/jacsau.4c00069 |
| spellingShingle | Dezhou Guo Yuanyuan Wei Sergey V. Zybin Yan Liu Fenglei Huang William A. Goddard Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations JACS Au |
| title | Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations |
| title_full | Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations |
| title_fullStr | Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations |
| title_full_unstemmed | Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations |
| title_short | Detonation Performance of Insensitive Nitrogen-Rich Nitroenamine Energetic Materials Predicted from First-Principles Reactive Molecular Dynamics Simulations |
| title_sort | detonation performance of insensitive nitrogen rich nitroenamine energetic materials predicted from first principles reactive molecular dynamics simulations |
| url | https://doi.org/10.1021/jacsau.4c00069 |
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