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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
作者:  Sun C(孙岑);  Zhu, Aixue;  Xu, Tong;  Wei XL(魏小林);  Hong, Dikun
收藏  |  浏览/下载:19/0  |  提交时间:2023/09/05
Visualized Reaction Tracking and Physical Property Analysis for a Picked 3D Area in a Reactive Molecular Dynamics Simulation System 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2021, 卷号: 37, 期号: 10, 页码: 11
作者:  Tang, Yujie;  Zheng, Mo;  Ren, Chunxing;  Li, Xiaoxia;  Guo, Li
收藏  |  浏览/下载:22/0  |  提交时间:2021/08/31
ReaxFF Molecular Dynamics Simulations of Thermal Reactivity of Various Fuels in Pyrolysis and Combustion 期刊论文
ENERGY & FUELS, 2021, 卷号: 35, 期号: 15, 页码: 11707-11739
作者:  Li, Xiaoxia;  Zheng, Mo;  Ren, Chunxing;  Guo, Li
收藏  |  浏览/下载:26/0  |  提交时间:2021/10/15
Dynamic migration mechanism of organic oxygen in Fugu coal pyrolysis by large-scale ReaxFF molecular dynamics 期刊论文
JOURNAL OF ANALYTICAL AND APPLIED PYROLYSIS, 2021, 卷号: 156, 页码: 9
作者:  Gao, Mingjie;  Li, Xiaoxia;  Guo, Xin;  Chen, Lei;  Sun, Laizhi
收藏  |  浏览/下载:24/0  |  提交时间:2021/08/31
Dynamic trends for char/soot formation during secondary reactions of coal pyrolysis by large-scale reactive molecular dynamics 期刊论文
JOURNAL OF ANALYTICAL AND APPLIED PYROLYSIS, 2021, 卷号: 155, 页码: 11
作者:  Zheng, Mo;  Li, Xiaoxia;  Guo, Li
收藏  |  浏览/下载:18/0  |  提交时间:2021/08/31
Numerical simulation of co-injection of pulverized coal and blast furnace gas separated by a membrane 期刊论文
Ironmaking and Steelmaking, 2021, 卷号: 48, 期号: 3, 页码: 324-333
作者:  Jiang, Lili;  Zhao, Yuanshou;  Meng, Yimin;  Tu, Sihao;  Chen, Zhaoyu
收藏  |  浏览/下载:2/0  |  提交时间:2021/06/03
Study onCO(2)gasification kinetics of biomass char based on pore structure analysis: Theoretical modelling of structural parameter psi in random pore model 期刊论文
INTERNATIONAL JOURNAL OF ENERGY RESEARCH, 2020, 页码: 14
作者:  Song, Qianshi;  Wang, Xiaohan;  Gu, Chunhan;  Li, Haowen;  Huo, Jiepeng
收藏  |  浏览/下载:9/0  |  提交时间:2021/10/22
ReaxFF MD反应分子体系时空性质分析与可视化 学位论文
: 中国科学院大学, 2020
作者:  唐钰杰
收藏  |  浏览/下载:28/0  |  提交时间:2021/09/07
Capturing the dynamic profiles of products in Hailaer brown coal pyrolysis with reactive molecular simulations and experiments 期刊论文
FUEL, 2020, 卷号: 268, 页码: 12
作者:  Zheng, Mo;  Pan, Yang;  Wang, Ze;  Li, Xiaoxia;  Guo, Li
收藏  |  浏览/下载:4/0  |  提交时间:2020/05/21
Dynamic profiles of tar products during Naomaohu coal pyrolysis revealed by large-scale reactive molecular dynamic simulation 期刊论文
FUEL, 2019, 卷号: 253, 页码: 910-920
作者:  Zheng, Mo;  Li, Xiaoxia;  Wang, Meijun;  Guo, Li
收藏  |  浏览/下载:59/0  |  提交时间:2019/09/03


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