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Calculation and prediction of sliding energy barriers by ffrst-principles combined with machine learning 期刊论文
Ceramics International, 2023, 期号: 49, 页码: 24752–24761
Authors:  Yuan Niu;  Yun Wang;  Minjuan He;  Wenhao He;  Zhenghua Zha;  Zhibin Lu
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First-principles calculations  Machine learning  Maximum sliding energy barrier  Elemental 2D materials  Friction  Interfacial charge transfer  
Green hydrophobic deep eutectic solvents as low-viscosity and efffcient lubricants 期刊论文
Tribology International, 2023, 期号: 185, 页码: 108531
Authors:  Yuting Li;  Cheng Cao;  Meng Cai;  Hao Li;  Xiaoqiang Fan;  Yu Gao;  Zhibin Lu;  Minhao Zhu
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Green lubricants  Hydrophobic deep eutectic solvents  Ultra-low viscosity  Anti-wear mechanism  First-principles calculations  
Friction behavior and structural evolution of hexagonal boron nitride: a relation to environmental molecules containing −OH functional group 期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2022, 卷号: 14, 期号: 25, 页码: 29462–29463
Authors:  Bai Changning;  Zhang Bin
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hexagonal boron nitride  friction behavior  structural evolution  first-principles calculations  dissociative adsorption  
How Vertical Compression Triggers Lateral Interlayer Slide for Metallic Molybdenum Disulfide? 期刊论文
Tribology Letters, 2018, 卷号: 66, 期号: 1, 页码: 21(1-8)
Authors:  Sun JH(孙军辉);  Zhang, Yanning;  Feng, Yanqing;  Lu ZB(鲁志斌);  Xue QJ(薛群基);  Du, Shiyu;  Wang LP(王立平);  Lu ZB(鲁志斌);  Xue QJ(薛群基);  Wang LP(王立平)
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Mos2  Layered Structures  Vertical Compression  Interfacial Shear  Structural Transitions  First-principles Calculations  
Structural, electronic and optical properties of famatinite and enargite Cu3SbS4 under pressure: A theoretical investigation 期刊论文
Physica Status Solidi (b)-basic solid state physics, 2017, 卷号: 254, 期号: 5, 页码: 1600608(1-10)
Authors:  Li J(李健);  Han XX(韩修训);  Li JJ(李佳佳);  Zhao Y(赵雲);  Fan, Changzeng;  Han XX(韩修训)
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Band Gap  Cu3sbs4  First-principles Calculations  High Pressure  Phase Stability  
Theoretical investigation of structural, mechanical and electronic properties of GaAs1-xNx alloys under ambient and high pressure 期刊论文
Physica B: Condensed Matter, 2017, 卷号: 526, 页码: 1-6
Authors:  Li J(李健);  Han XX(韩修训);  Dong C(董琛);  Fan, Changzeng;  Han XX(韩修训)
Adobe PDF(1495Kb)  |  Favorite  |  View/Download：92/2  |  Submit date：2017/12/18
First-principles Calculations  Gaas1-xnx Alloys  High Pressure  Dilute Nitrides  n Concentration  Band Gap