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聚叠氮缩水甘油醚GAP热分解特性研究 期刊论文
工程热物理学报, 2024, 卷号: 45, 期号: 09, 页码: 2839-2846./通讯作者：周银涛
作者:  周银涛;  初庆钊;  廖丽涓;  毛倩;  石保禄
Adobe PDF(934Kb)  |  收藏  |  浏览/下载：103/25  |  提交时间：2024/10/18
分子动力学  ReaxFF反应力场  聚叠氮缩水甘油醚  热分解机理  
Atomic-level analysis of migration and transformation of organic sodium in high-alkali coal pyrolysis using reactive molecular dynamics simulations 期刊论文
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING, 2023, 卷号: 11, 期号: 3, 页码: 110189./通讯作者：Wei, XL (corresponding author), Chinese Acad Sci, Inst Mech, State Key Lab High Temp Gas Kinet, Beijing 100190, Peoples R China.
作者:  Sun C(孙岑);  Zhu, Aixue;  Xu, Tong;  Wei XL(魏小林);  Hong, Dikun;  Si, Tong
Adobe PDF(8251Kb)  |  收藏  |  浏览/下载：143/39  |  提交时间：2023/09/05
Inherent organic sodium  ReaxFF  Pyrolysis  Molecular simulation  Py-GC/MS  
A chemo mechanical coupling model of oxidation and interlayer cracking of copper nanowires 期刊论文
JOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS, 2023, 卷号: 174, 页码: 105259./通讯作者：Shi, XH (corresponding author), Chinese Acad Sci, CAS Ctr Excellence Nanosci, Natl Ctr Nanosci & Technol, Lab Theoret & Computat Nanosci, Beijing 100190, Peoples R China., Shi, XH (corresponding author), Univ Chinese Acad Sci, 19A Yuquan Rd, Beijing 100049, Peoples R China.
作者:  Gong, Yulong;  Yan, Xin;  Wen JC(温济慈);  Meng, Qinghua;  Li, Ang;  Shi, Xinghua
Adobe PDF(9859Kb)  |  收藏  |  浏览/下载：293/56  |  提交时间：2023/04/20
Chemo mechanical coupling  Interlayer cracking  ReaxFF  Energy release rate  Oxidation  Copper nanowires