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Chemical Insight on Decreased Sensitivity of CL-20/TNT Cocrystal Revealed by ReaxFF MD Simulations 期刊论文
JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2019, 卷号: 59, 期号: 5, 页码: 2079-2092
Authors:  Ren, Chunxing;  Li, Xiaoxia;  Guo, Li
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Construction of a Multicomponent Molecular Model of Fugu Coal for ReaxFF-MD Pyrolysis Simulation 期刊论文
ENERGY & FUELS, 2019, 卷号: 33, 期号: 4, 页码: 2848-2858
Authors:  Gao, Mingjie;  Li, Xiaoxia;  Ren, Chunxing;  Wang, Ze;  Pan, Yang;  Guo, Li
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Reaction Mechanisms in the Thermal Decomposition of CL-20 Revealed by ReaxFF Molecular Dynamics Simulations 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2018, 卷号: 34, 期号: 10, 页码: 1151-1162
Authors:  Ren Chunxing;  Li Xiaoxia;  Guo Li
Adobe PDF(897Kb)  |  Favorite  |  View/Download:83/0  |  Submit date:2018/07/06
Cl-20  Thermal Decomposition  Reaction Mechanism  Reaxff Md  Evolution Of Ring Structure  
大规模反应分子动力学模拟新进展 会议论文
中国化学会第14届全国计算(机)化学学术会议暨分子模拟国际论坛会议手册, 中国江苏南京, 2017-11-17
Authors:  李晓霞;  郑默;  张婷婷;  韩嵩;  高明杰;  任春醒;  郭力
Adobe PDF(673Kb)  |  Favorite  |  View/Download:24/0  |  Submit date:2019/06/17
Reaxff Md  热解与氧化  反应机理  大规模分子模拟  
Enhanced biogas production from sorghum stem by co-digestion with cow manure 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2016, 卷号: 41, 期号: 21, 页码: 9153-9158
Authors:  Zhang, Zhikai;  Zhang, Guangyi;  Li, Wangliang;  Li, Chunxing;  Xu, Guangwen
Adobe PDF(899Kb)  |  Favorite  |  View/Download:91/0  |  Submit date:2016/08/22
Sorghum Stem  Biogas  Hydrogen  Anaerobic Digestion  Co-digestion  
Characterization of NO emission in combustion of hydrothermally treated antibiotic mycelial residue 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2016, 卷号: 284, 期号: JAN, 页码: 708-715
Authors:  Ma, Dachao;  Zhang, Guangyi;  Areeprasert, Chinnathan;  Li, Chunxing;  Shen, Yafei;  Yoshikawa, Kunio;  Xu, Guangwen
Adobe PDF(1699Kb)  |  Favorite  |  View/Download:112/0  |  Submit date:2016/01/04
Hydrothermal Treatment  Antibiotic Mycelial Residue  High-nitrogen Solid Biofuel  No Emission  Air-staged Combustion  
CL-20/TNT含能共晶热分解的ReaxFF MD模拟 会议论文
中国化学会第30届学术年会摘要集-第四十六分会:燃烧化学, 中国辽宁大连, 2016-07-01
Authors:  任春醒;  李晓霞;  聂峰光;  郭力
Adobe PDF(296Kb)  |  Favorite  |  View/Download:120/0  |  Submit date:2017/05/31
热分解  Reaxff Md  Cl-20/tnt  反应机理  
CL-20/TNT含能共晶热分解的ReaxFF MD模拟 会议论文
中国化学会第30届学术年会摘要集-第四十六分会:燃烧化学, 2016
Authors:  任春醒
Favorite  |  View/Download:25/0  |  Submit date:2018/09/05
热分解  ReaxFF MD  CL-20/TNT  反应机理