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Accurate and Efficient Estimation of Lennard-Jones Interactions for Coarse-Grained Particles via a Potential Matching Method 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2022, 卷号: 18, 期号: 8, 页码: 4879-4890
作者:  Zhang, Yuwei;  Wang, Yunchu;  Xia, Fei;  Cao, Zexing;  Xu, Xin
收藏  |  浏览/下载:10/0  |  提交时间:2023/02/07
On the determination of Lennard-Jones parameters for polyatomic molecules 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24, 期号: 17, 页码: 10147-10159
作者:  Mo HR(莫晃锐);  You XQ;  Luo KH;  Robertson SH
收藏  |  浏览/下载:31/0  |  提交时间:2022/05/17
A strain-rate cohesive fracture model of rocks based on Lennard-Jones potential 期刊论文
ENGINEERING FRACTURE MECHANICS, 2022, 卷号: 259, 页码: 21
作者:  Lin QD(林钦栋);  Li SH(李世海);  Gan, Yundan;  Feng C(冯春)
收藏  |  浏览/下载:38/0  |  提交时间:2022/01/12
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
作者:  Chen, Yue;  Chen, Wei;  Chen, Xiaosong
收藏  |  浏览/下载:4/0  |  提交时间:2023/01/16
Cohesive fracture model of rocks based on multi-scale model and Lennard-Jones potential 期刊论文
ENGINEERING FRACTURE MECHANICS, 2021, 卷号: 246, 页码: 26
作者:  Lin QD(林钦栋);  Li SH(李世海);  Feng C(冯春);  Wang XQ(王心泉)
收藏  |  浏览/下载:37/0  |  提交时间:2021/04/19
Energy exchange rate coefficients from vibrational inelastic O-2(Sigma g-3) + O-2(Sigma g-3) collisions on a new spin-averaged potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2021, 卷号: 154, 期号: 6, 页码: 16
作者:  Hong QZ(洪启臻);  Sun QH(孙泉华);  Pirani, Fernando;  ValentinRodriguez, Monica A;  HernandezLamoneda, Ramon
收藏  |  浏览/下载:29/0  |  提交时间:2021/04/19
Energy exchange rate coefficients from vibrational inelastic O2(Σg−3) + O2(Σg−3) collisions on a new spin-averaged potential energy surface 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2021, 卷号: 154, 期号: 6, 页码: 064304
作者:  Hong QZ(洪启臻);  Sun QH(孙泉华);  Pirani F;  Valentín-Rodríguez M;  Hernández-Lamoneda R
收藏  |  浏览/下载:19/0  |  提交时间:2021/02/20
Tolman length of simple droplet: Theoretical study and molecular dynamics simulation* 期刊论文
CHINESE PHYSICS B, 2021, 卷号: 30, 期号: 1, 页码: 6
作者:  Cui SW(崔树稳);  Wei, Jiu-An;  Li, Qiang;  Liu, Wei-Wei;  Qian, Ping
收藏  |  浏览/下载:129/0  |  提交时间:2021/03/03
液氩的热力学性质计算与组成结构分析 学位论文
: 中国科学院大学, 2020
作者:  孙晨阳
收藏  |  浏览/下载:10/0  |  提交时间:2021/09/07
Modification of glycerol force Field for simulating silver nucleation under a diffusion limited condition 期刊论文
COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 2020, 卷号: 592, 页码: 8
作者:  Dou, Xiangyu;  Chen, Yongxiu;  Han, Yongsheng
收藏  |  浏览/下载:2/0  |  提交时间:2020/05/21


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