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Comparison of empirical potentials for calculating structural properties of amorphous carbon films by molecular dynamics simulation 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 151, 页码: 246-254
作者:  Wang, Aiying;  Lee, Kwang-Ryeol;  Li, Xiaowei
收藏  |  浏览/下载：67/0  |  提交时间：2018/12/04
The correlation between mechanical properties and structure of Fe-Ni-P-B amorphous alloys: Ab initio molecular dynamics simulations 期刊论文
JOURNAL OF NON-CRYSTALLINE SOLIDS, 2018, 卷号: 491, 页码: 43106
作者:  Chang, Chuntao;  Li, Hongxiang;  Yang, Weiming;  Zhang, Wenbiao;  Duan, Haiming
收藏  |  浏览/下载：110/0  |  提交时间：2018/12/04
The permeation mechanism of organic cations through a CNG mimic channel 期刊论文
PLOS COMPUTATIONAL BIOLOGY, 2018, 卷号: 14, 期号: 8
作者:  Marchesi, Arin;  Rodriguez, Alex;  De March, Matteo;  Onesti, Silvia;  Laio, Alessandro
收藏  |  浏览/下载：18/0  |  提交时间：2018/12/04
How Does the Hydrogen Bonding Interaction Influence the Properties of Polybenzoxazine? An Experimental Study Combined with Computer Simulation 期刊论文
MACROMOLECULES, 2018, 卷号: 51, 期号: 13, 页码: 4782-4799
作者:  Zhu, Jin;  Du, Shiyu;  Liu, Xiaoqing;  Dai, Jinyue;  Liu, Yuan
收藏  |  浏览/下载：35/0  |  提交时间：2018/12/04
The correlation between mechanical properties and structure of Fe-Ni-P-B amorphous alloys: Ab initio molecular dynamics simulations 期刊论文
JOURNAL OF NON-CRYSTALLINE SOLIDS, 2018, 卷号: 491, 页码: 43106
作者:  Chang, Chuntao;  Li, Hongxiang;  Yang, Weiming;  Zhang, Wenbiao;  Duan, Haiming
收藏  |  浏览/下载：31/0  |  提交时间：2018/12/04

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