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SCI期刊论文 [214]
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Molecular Dynamics Simulation of the Structural, Mechanical, and Reprocessing Properties of Vitrimers Based on a Dynamic Covalent Polymer Network
期刊论文
MACROMOLECULES, 2022, 卷号: 55, 期号: 4, 页码: 1091-1103
Authors:
Zhao, Hengheng
;
Wei, Xuefeng
;
Fang, Yue
;
Gao, Ke
;
Yue, Tongkui
;
Zhang, Liqun
;
Ganesan, Venkat
;
Meng, Fanlong
;
Liu, Jun
Adobe PDF(6045Kb)
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Submit date:2023/01/16
ADAPTABLE NETWORKS
STRESS-RELAXATION
RUBBER ELASTICITY
LINEAR POLYMER
SHAPE-MEMORY
BOND
TEMPERATURE
VISCOELASTICITY
COMPOSITES
KINETICS
Effective range expansion for narrow near-threshold resonances
期刊论文
PHYSICS LETTERS B, 2022, 卷号: 833, 页码: 137290
Authors:
Baru, Vadim
;
Dong, Xiang-Kun
;
Du, Meng-Lin
;
Filin, Arseniy
;
Guo, Feng-Kun
;
Hanhart, Christoph
;
Nefediev, Alexey
;
Nieves, Juan
;
Wang, Qian
Adobe PDF(374Kb)
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DEUTERON
Size of Nanoscale Domains in Inhomogeneous Surfaces Determines Ice Nucleation
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2022, 卷号: 126, 期号: 31, 页码: 13373-13380
Authors:
Zhang, Chuanbiao
;
Wang, Yanting
;
Wang, Jianjun
;
Zhou, Xin
Adobe PDF(6172Kb)
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GRAPHENE OXIDE
HEXAGONAL ICE
WATER
SIMULATIONS
CARBON
INTERPLAY
GROWTH
IMPACT
A Machine Learning Model to Classify Dynamic Processes in Liquid Water**
期刊论文
CHEMPHYSCHEM, 2022
Authors:
Huang, Jie
;
Huang, Gang
;
Li, Shiben
Adobe PDF(3655Kb)
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Submit date:2023/01/16
JUMP MECHANISM
CLUSTERS
EXCHANGE
SPECTROSCOPY
DIFFUSION
NETWORKS
CELL
A classical density functional approach to depletion interaction of Lennard-Jones binary mixtures
期刊论文
COMMUNICATIONS IN THEORETICAL PHYSICS, 2022, 卷号: 74, 期号: 3, 页码: 35602
Authors:
Chen, Yue
;
Chen, Wei
;
Chen, Xiaosong
Adobe PDF(911Kb)
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Submit date:2023/01/16
EQUATION-OF-STATE
MEAN SPHERICAL APPROXIMATION
FREE-ENERGY MODEL
PERTURBATION-THEORY
FLUID MIXTURE
FORCES
NONUNIFORM
SEPARATION
SOLUTE
The structuring effect of the alkyl domains on the polar network of ionic liquid mixtures: a molecular dynamics study
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 31, 页码: 18783-18792
Authors:
Mazzilli, Valerio
;
Wang, Yanting
;
Saielli, Giacomo
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SPATIAL HETEROGENEITY
AGGREGATION
SIMULATIONS
CATIONS
Theoretical analysis of RNA polymerase fidelity: a steady-state copolymerization approach
期刊论文
COMMUNICATIONS IN THEORETICAL PHYSICS, 2022, 卷号: 74, 期号: 1, 页码: 15601
Authors:
Fu, Wenbo
;
Li, Qiushi
;
Song, Yongshun
;
Shu, Yaogen
;
Ouyang, Zhongcan
;
Li, Ming
Adobe PDF(597Kb)
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Submit date:2023/01/16
MECHANISM
TRANSCRIPT
ACCURACY
CLEAVAGE
ERRORS
Role of an Ice Surface in the Photoreaction of Coumarins
期刊论文
LANGMUIR, 2022, 卷号: 38, 期号: 37, 页码: 11346-11353
Authors:
Zhang, Shizhong
;
Zhang, Chuanbiao
;
Fu, Yang
;
Li, Linhai
;
Huang, Chuanbing
;
Lin, Yang
;
Zhu, Chongqin
;
Francisco, Joseph S.
;
He, Zhiyuan
;
Zhou, Xin
;
Wang, Jianjun
Adobe PDF(5463Kb)
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Submit date:2023/01/16
SINGLE-CRYSTALS
CHEMISTRY
WATER
PHOTOCHEMISTRY
CYCLOADDITION
ADSORPTION
REACTIVITY
CHLORIDE
COMPLEX
LIGHT
Room temperature bilayer water structures on a rutile TiO2(110) surface: hydrophobic or hydrophilic?
期刊论文
CHEMICAL SCIENCE, 2022, 卷号: 13, 期号: 35, 页码: 10546-10554
Authors:
Qu, Mengyang
;
Huang, Gang
;
Liu, Xinyi
;
Nie, Xuechuan
;
Qi, Chonghai
;
Wang, Huabin
;
Hu, Jun
;
Fang, Haiping
;
Gao, Yi
;
Liu, Wei-Tao
;
Francisco, Joseph S.
;
Wang, Chunlei
Adobe PDF(761Kb)
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Submit date:2023/01/16
SUM-FREQUENCY GENERATION
MOLECULAR-DYNAMICS
INTERFACIAL WATER
TITANIUM-DIOXIDE
ELECTRON-TRANSFER
TIO2
SPECTROSCOPY
ADSORPTION
LAYER
PHOTOOXIDATION
Gradient nano-grained graphene as 2D thermal rectifier: A molecular dynamics based machine learning study
期刊论文
APPLIED PHYSICS LETTERS, 2022, 卷号: 121, 期号: 13, 页码: 133501
Authors:
Xu, Ke
;
Liang, Ting
;
Fu, Yuequn
;
Wang, Zhen
;
Fan, Zheyong
;
Wei, Ning
;
Xu, Jianbin
;
Zhang, Zhisen
;
Wu, Jianyang
Adobe PDF(7067Kb)
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Submit date:2023/01/16