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浏览/检索结果: 共17条，第1-10条 帮助 限定条件 发表日期：2022    专题：金属研究所    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Molecular dynamics study on the contribution of anisotropic phonon transmission to thermal conductivity of silicon 期刊论文 JOURNAL OF PHYSICS-CONDENSED MATTER, 2022, 卷号: 34, 期号: 43, 页码: 10 作者:  Cheng, Chao;  Wang, Shaoqing 收藏  |  浏览/下载：17/0  |  提交时间：2022/10/08 Fourier projection method  molecular dynamics  anharmonic vibration  thermal conductivity   Theoretical design of BAs/WX2 (X = S, Se) heterostructures for high-performance photovoltaic applications from DFT calculations 期刊论文 APPLIED SURFACE SCIENCE, 2022, 卷号: 599, 页码: 11 作者:  Guan, Yue;  Li, Xiaodan;  Hu, Qingmiao;  Zhao, Dandan;  Zhang, Lin 收藏  |  浏览/下载：35/0  |  提交时间：2022/09/16 First principle calculations  2D materials  Heterojunction  Electronic structure  Electric field  Photovoltaic applications   Theoretical prediction on structure evolution and optimal properties of silicon modified hexagonal boron nitride as interphase in SiCf/SiC composite 期刊论文 JOURNAL OF THE EUROPEAN CERAMIC SOCIETY, 2022, 卷号: 42, 期号: 13, 页码: 5323-5333 作者:  Zhang, Siyan;  Liu, Mei;  Luo, Yixiu;  Sun, Luchao;  Wang, Jiemin 收藏  |  浏览/下载：37/0  |  提交时间：2022/09/16 Ab Initio molecular dynamics (AIMD)  Si-doped h-BN  Ceramic matrix composites (CMCs)  Interphase   Modulation of morphology and electronic structure on MoS2-based electrocatalysts for water splitting 期刊论文 NANO RESEARCH, 2022, 页码: 26 作者:  Liu, Mengmeng;  Zhang, Chunyan;  Han, Ali;  Wang, Ling;  Sun, Yujia 收藏  |  浏览/下载：16/0  |  提交时间：2022/09/16 MoS2  morphology  electronic structure  electrocatalysis  water splitting   Modulation of morphology and electronic structure on MoS2-based electrocatalysts for water splitting 期刊论文 NANO RESEARCH, 2022, 页码: 26 作者:  Liu, Mengmeng;  Zhang, Chunyan;  Han, Ali;  Wang, Ling;  Sun, Yujia 收藏  |  浏览/下载：24/0  |  提交时间：2022/09/16 MoS2  morphology  electronic structure  electrocatalysis  water splitting   Exploring Hf-Ta-O precipitation upon ablation of Hf-Ta-Si-C coating on C/C composites 期刊论文 JOURNAL OF THE EUROPEAN CERAMIC SOCIETY, 2022, 卷号: 42, 期号: 6, 页码: 2586-2596 作者:  Tong, Mingde;  Chen, Chunjin;  Fu, Qiangang;  Feng, Tao;  Hou, Wanbo 收藏  |  浏览/下载：93/0  |  提交时间：2022/07/01 Ultrahigh temperature ceramics  Precipitation  Ablation  Coating   Cucumber (Cucumis sativus L.) Leaf Extract as a Green Corrosion Inhibitor for Carbon Steel in Acidic Solution: Electrochemical, Functional and Molecular Analysis 期刊论文 MOLECULES, 2022, 卷号: 27, 期号: 12, 页码: 18 作者:  Feng, Lijuan;  Zhang, Shanshan;  Hao, Long;  Du, Hongchen;  Pan, Rongkai 收藏  |  浏览/下载：15/0  |  提交时间：2022/09/16 carbon steel  extract  green corrosion inhibitor  quantum chemical calculation   Atomic-Scale Design of Anode Materials for Alkali Metal (Li/Na/K)-Ion Batteries: Progress and Perspectives 期刊论文 ADVANCED ENERGY MATERIALS, 2022, 页码: 29 作者:  Olsson, Emilia;  Yu, Jiale;  Zhang, Haiyan;  Cheng, Hui-Ming;  Cai, Qiong 收藏  |  浏览/下载：28/0  |  提交时间：2022/07/14 anodes  density functional theory  lithium-ion batteries  materials design  molecular dynamics  potassium-ion batteries  sodium-ion batteries   Defect formation and bending properties in graphite under He atom implantation investigated by molecular dynamics method 期刊论文 CARBON, 2022, 卷号: 191, 页码: 350-361 作者:  Long, X. H.;  Setyawan, W.;  Tai, K. P.;  Liu, Y.;  Yu, M. S. 收藏  |  浏览/下载：24/0  |  提交时间：2022/07/01 Molecular dynamics  Graphite  Atomic implantation  Radiation defects  Bending properties   Cluster Hardening Effects on Twinning in Mg-Zn-Ca Alloys 期刊论文 METALS, 2022, 卷号: 12, 期号: 4, 页码: 10 作者:  Liu, Ruixue;  Wang, Jie;  Wang, Leyun;  Zeng, Xiaoqin;  Jin, Zhaohui 收藏  |  浏览/下载：18/0  |  提交时间：2022/07/01 Mg-Zn-Ca alloy  twin boundary  solute cluster hardening  molecular dynamics simulation