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SiO碳包覆层织构调控及其电化学性能研究 学位论文
: 中国科学院大学过程工程研究所, 2023
Authors:  shi hebang
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醇类表面活性剂光照下产生VOCs二次污染的机理研究 学位论文
工学博士, 过程大厦B304: 中国科学院大学过程工程研究所, 2023
Authors:  林景怡
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气-水界面  单线态氧  
基于阴离子与手性调控的短肽自组装与酶催化研究 学位论文
工学博士学位: 中国科学院过程工程研究所, 2023
Authors:  李欣
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自组装  短肽  阴离子  手性  酶催化  
Electropumping of water in nanochannels using non-uniform electric fields 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2023, 卷号: 267, 页码: 12
Authors:  Xu, Yinxiang;  Xu, Junbo;  Liu, Huizhou;  Yang, Chao
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Electropumping  Net flow  Nanochannel  Molecular dynamics simulation  Non -uniform electric field  
Interfacial role of Ionic liquids in CO2 electrocatalytic Reduction: A mechanistic investigation 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2023, 卷号: 457, 页码: 10
Authors:  Guo, Shuai;  Liu, Yawei;  Wang, Yanlei;  Dong, Kun;  Zhang, Xiangping;  Zhang, Suojiang
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Ionic liquids  CO(2 )electrocatalytic reduction reaction  Density functional theory  Transition state  Hydrogen bond  Molecular dynamics simulations  
Revisiting the structure, interaction, and dynamical property of ionic liquid from the deep learning force field 期刊论文
JOURNAL OF POWER SOURCES, 2023, 卷号: 555, 页码: 8
Authors:  Ling, Yulong;  Li, Kun;  Wang, Mi;  Lu, Junfeng;  Wang, Chenlu;  Wang, Yanlei;  He, Hongyan
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Ionic liquids  Molecular dynamics simulations  Force field  Hydrogen bond  Machine learning  
Revealing the wetting mechanism of Li plus -doped ionic liquids on the TiO2 surface 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2023, 卷号: 265, 页码: 9
Authors:  Wang, Chenlu;  Liu, Guangyong;  Cao, Renqiang;  Xia, Yu;  Wang, Yanlei;  Nie, Yi;  Yang, Chao;  He, Hongyan
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Ionic liquids  Lithium-ion  Electrode interface  Molecular dynamics simulation  Energy storage  
A new correlation model for predicting the melting and boiling temperatures of the Lennard-Jones systems 期刊论文
PHYSICA SCRIPTA, 2023, 卷号: 98, 期号: 1, 页码: 11
Authors:  Sun, Chenyang;  Zhang, Yaning;  Hou, Chaofeng;  Ge, Wei
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molecular dynamics simulation  LJ potential  phase transition temperature  correlation model  
Ionic liquids enable highly efficient Knoevenagel reaction by dual-responsive emulsion microreactor 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2023, 卷号: 451, 页码: 9
Authors:  Yuan, Xiaoqing;  Liu, Ju;  Wang, Yanlei;  Jie, Xingming;  Qin, Jingyu;  He, Hongyan
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Ionic liquids  Stimuli-responsive  Knoevenagel condensation  Emulsion microreactor  
Co-pyrolysis behaviors of coal and polyethylene by combining in-situ Py-TOF-MS and reactive molecular dynamics 期刊论文
FUEL, 2023, 卷号: 331, 页码: 14
Authors:  Feng, Wei;  Zheng, Mo;  Jin, Lijun;  Bai, Jin;  Kong, Lingxue;  Li, Huaizhu;  Bai, Zongqing;  Li, Wen
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Low-rank coal  Polyethylene  Co-pyrolysis  ReaxFF MD  Py-TOF-MS