机构

• 上海应用物理研究所 [23]
• 宁波材料技术与工程... [19]
• 大连化学物理研究所 [11]
• 上海硅酸盐研究所 [9]
• 金属研究所 [8]
• 长春光学精密机械与物... [5]
• 更多

采集方式

• OAI收割 [87]
• iSwitch采集 [2]

内容类型

• 期刊论文 [89]

发表日期

• 2019 [89]

学科主题

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浏览/检索结果: 共89条，第1-10条 帮助 限定条件 发表日期：2019     条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序题名升序题名降序作者升序作者降序发表日期升序发表日期降序 Atomic bonding and electronic stability of the binary sigma phase 期刊论文  OAI收割 JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 811, 页码: 8 作者:  Liu, Wei;  Lu, Xiao-Gang   |  收藏  |  浏览/下载：14/0  |  提交时间：2021/02/02 sigma phase  atomic bonding  electronic stability  DOS  ELF  first-principles calculations   Stable Discrete Pt-1(0) in Crown Ether with Ultra-High Hydrosilylation Activity 期刊论文  OAI收割 CHEMCATCHEM, 2019, 页码: 7 作者:  Liu, Kairui;  Shen, Xing;  Bai, Shi;  Zhang, Z. Conrad   |  收藏  |  浏览/下载：13/0  |  提交时间：2020/03/24 Crown Ether  Density Functional Calculations  Hydrosilylation  Metal Atom Catalyst  Platinum   First-principles study of hydrogen-vacancy complexes in Be12Ti 期刊论文  OAI收割 JOURNAL OF NUCLEAR MATERIALS, 2019, 卷号: 525, 页码: 7-13 作者:  Zhu, Xiaolu;  Wang, Canglong;  Meng, Zhaocang   |  收藏  |  浏览/下载：59/0  |  提交时间：2019/11/10 First-principles calculations  H atoms  Vacancy trapping  Be12Ti   The structure properties, defect stability and excess properties in Am-doped LnPO(4) (Ln = La, Ce, Nd, Sm, Eu, Gd) monazites 期刊论文  OAI收割 JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 806, 页码: 113-119 作者:  Teng, Yuancheng;  Yang, Xiaoyong;  Wu, Lang;  Wang, Lili;  Zhang, Tongmin   |  收藏  |  浏览/下载：75/0  |  提交时间：2019/11/10 Monazite  Am  First principles calculations  Defect stability  Excess property   Strong metal-metal interaction and bonding nature in metal/oxide interfaces with large mismatches 期刊论文  OAI收割 ACTA MATERIALIA, 2019, 卷号: 179, 页码: 237-246 作者:  Li, Hongping;  Saito, Mitsuhiro;  Chen, Chunlin;  Inoue, Kazutoshi;  Akagi, Kazuto   |  收藏  |  浏览/下载：14/0  |  提交时间：2021/02/02 Metal/oxide incoherent interface  Scanning transmission electron microscopy  First-principles calculations  Atomic-scale structure  Bonding nature   Strong metal-metal interaction and bonding nature in metal/oxide interfaces with large mismatches 期刊论文  OAI收割 ACTA MATERIALIA, 2019, 卷号: 179, 页码: 237-246 作者:  Li, Hongping;  Saito, Mitsuhiro;  Chen, Chunlin;  Inoue, Kazutoshi;  Akagi, Kazuto   |  收藏  |  浏览/下载：12/0  |  提交时间：2021/02/02 Metal/oxide incoherent interface  Scanning transmission electron microscopy  First-principles calculations  Atomic-scale structure  Bonding nature   First principles investigations of hydrogen interaction with vacancy-oxygen complexes in vanadium alloys 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2019, 卷号: 44, 期号: 48, 页码: 26637-26645 作者:  Zhang, Pengbo;  Zou, Tingting;  Feng, Shaobo;  Zhao, Jijun   |  收藏  |  浏览/下载：12/0  |  提交时间：2021/02/02 Hydrogen  Vacancy-oxygen  Vanadium alloys  First principles calculations   Tuning electronic and optical properties of CsPbI3 by applying strain: A first-principles theoretical study 期刊论文  OAI收割 CHEMICAL PHYSICS LETTERS, 2019, 卷号: 732, 页码: 4 作者:  Jing, Huijuan;  Sa, Rongjian;  Xu, Ge   |  收藏  |  浏览/下载：87/0  |  提交时间：2019/12/02 Hydrostatic strain  CsPbI3  Electronic properties  Mechanical properties  First-principles calculations   First-principles study of dopant stability and related optical properties in CdSiP2 crystal 期刊论文  OAI收割 JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 802, 页码: 310-317 作者:  Wang, Ci;  Zhang, Jian;  Hu, Qingmiao;  Tao, Xutang   |  收藏  |  浏览/下载：9/0  |  提交时间：2021/02/02 First-principles calculations  CdSiP2  Doping defects  Formation energy  Optical property   First-principles study of dopant stability and related optical properties in CdSiP2 crystal 期刊论文  OAI收割 JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 802, 页码: 310-317 作者:  Wang, Ci;  Zhang, Jian;  Hu, Qingmiao;  Tao, Xutang   |  收藏  |  浏览/下载：12/0  |  提交时间：2021/02/02 First-principles calculations  CdSiP2  Doping defects  Formation energy  Optical property