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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
Authors:  Gao, Mingjie;  Li, Xiaoxia;  Guo, Xin;  Chen, Lei;  Sun, Laizhi;  Yang, Shuangxia;  Xie, Xinping;  Hua, Dongliang
Favorite  |  View/Download：8/0  |  Submit date：2021/08/31
ReaxFF molecular dynamics simulation  Coal pyrolysis  Organic oxygen  Evolution trend  Migration mechanism  
Dilute solvent welding: A quick and scalable approach for enhancing the mechanical properties and narrowing the pore size distribution of electrospun nanofibrous membrane 期刊论文
JOURNAL OF MEMBRANE SCIENCE, 2020, 卷号: 595, 页码: 8
Authors:  Su, Chunlei;  Lu, Chun;  Horseman, Thomas;  Cao, Hongbin;  Duan, Feng;  Li, Lei;  Li, Mingjie;  Li, Yuping
Favorite  |  View/Download：65/0  |  Submit date：2020/03/24
Nanofiber  Strength  Pore size distribution  Welding  Membrane distillation  
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
Favorite  |  View/Download：97/0  |  Submit date：2019/06/14
Separation of Caustic Nano-Emulsions and Macromolecular Conformations with Nanofibrous Membranes of Marine Chitin 期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2019, 卷号: 11, 期号: 8, 页码: 8576-8583
Authors:  Wang, Zengbin;  Xu, Jie;  Li, Mingjie;  Su, Chunlei;  Wu, Xiaochen;  Zhang, Yue;  You, Jun;  Li, Chaoxu
Favorite  |  View/Download：94/0  |  Submit date：2019/06/14
chitin nanofibrils  nanoporous membranes  nanoemulsion  caustic resistance  nanoparticles  
An integrated high-throughput strategy enables the discovery of multifunctional ionic liquids for sustainable chemical processes 期刊论文
GREEN CHEMISTRY, 2019, 卷号: 21, 期号: 2, 页码: 307-313
Authors:  Zhu, Anlian;  Li, Lingjun;  Zhang, Chi;  Shen, Yutan;  Tang, Mingjie;  Bai, Lili;  Du, Chunyan;  Zhang, Suojiang;  Wang, Jianji
Adobe PDF(2076Kb)  |  Favorite  |  View/Download：125/0  |  Submit date：2019/04/03
Atomic Co/Ni dual sites and Co/Ni alloy nanoparticles in N-doped porous Janus-like carbon frameworks for bifunctional oxygen electrocatalysis 期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2019, 卷号: 240, 页码: 112-121
Authors:  Li, Zehui;  He, Hongyan;  Cao, Hongbin;  Sun, Shaoming;  Diao, Wenlin;  Gao, Denglei;  Lu, Peilong;  Zhang, Shuangshuang;  Guo, Zhuang;  Li, Mingjie;  Liu, Rongji;  Ren, Dunhao;  Liu, Chenming;  Zhang, Yi;  Yang, Zheng;  Jiang, Jingkun;  Zhang, Guangjin
Adobe PDF(3883Kb)  |  Favorite  |  View/Download：119/0  |  Submit date：2019/06/14
Atomic  Dual Sites  Electrocatalysts  Oxygen Reduction Reaction  Oxygen Evolution Reaction  
Nitrogen-rich core-shell structured particles consisting of carbonized zeolitic imidazolate frameworks and reduced graphene oxide for amperometric determination of hydrogen peroxide 期刊论文
MICROCHIMICA ACTA, 2018, 卷号: 185, 期号: 11, 页码: 9
Authors:  Li, Zehui;  Jiang, Yuheng;  Wang, Zhuoya;  Wang, Wenbo;  Yuan, Yi;  Wu, Xiaoxue;  Liu, Xingchen;  Li, Mingjie;  Dilpazir, Sobia;  Zhang, Guangjin;  Wang, Dongbin;  Liu, Chenming;  Jiang, Jingkun
Adobe PDF(1875Kb)  |  Favorite  |  View/Download：154/0  |  Submit date：2018/12/04
Electrochemical Sensor  Electrocatalyst  Nitrogen Doped Carbon  H2o2  Screen-printed Electrode  
Pyrolysis simulations of Fugu coal by large-scale ReaxFF molecular dynamics 期刊论文
FUEL PROCESSING TECHNOLOGY, 2018, 卷号: 178, 页码: 197-205
Authors:  Gao, Mingjie;  Li, Xiaoxia;  Guo, Li
Adobe PDF(3167Kb)  |  Favorite  |  View/Download：148/0  |  Submit date：2018/10/11
Reaxff Molecular Dynamics  Coal Pyrolysis  Fugu Coal  Reaction Mechanism  Pyrolyzate Yield Prediction  Elevated Temperature Effect  
Emerging investigator series: dispersed transition metals on a nitrogen-doped carbon nanoframework for environmental hydrogen peroxide detection 期刊论文
ENVIRONMENTAL SCIENCE-NANO, 2018, 卷号: 5, 期号: 8, 页码: 1834
Authors:  Li, ZH;  Jiang, YH;  Liu, CM;  Wang, ZY;  Cao, ZQ;  Yuan, Y;  Li, MJ;  Wang, YL;  Fang, DL;  Guo, Z;  Wang, DB;  Zhang, GJ;  Jiang, JK;  Li, Zehui;  Jiang, Yuheng;  Liu, Chenming;  Wang, Zhuoya;  Cao, Zhiqin;  Yuan, Yi;  Li, Mingjie;  Wang, Yaling;  Fang, Daliang;  Guo, Zhuang;  Wang, Dongbin;  Zhang, Guangjin;  Jiang, Jingkun
Adobe PDF(4347Kb)  |  Favorite  |  View/Download：76/0  |  Submit date：2018/12/29
Oxygen Reduction Reaction  Electrochemical Detection  Organic Frameworks  Porous Carbon  Nanoparticles  Performance  Catalysts  Graphene  Glucose  Fe  
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：73/0  |  Submit date：2019/06/17
Reaxff Md  热解与氧化  反应机理  大规模分子模拟