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浏览/检索结果: 共15条，第1-10条 帮助 限定条件 专题：上海硅酸盐研究所    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 Iron-incorporated chalcopyrite of an intermediate band for improving solar wide-spectrum absorption 期刊论文 JOURNAL OF SOLID STATE CHEMISTRY, 2019, 卷号: 277, 页码: 388 作者:  Hu, Keyan;  Zhao, Yu;  Wang, Dong;  Zhang, Shaoning;  Zheng, Chong 收藏  |  浏览/下载：72/0  |  提交时间：2019/12/26 Intermediate bands  Fe-doped chalcopyrite  First principle calculations  Solar thermal collection  Photocatalytic degradation   Lattice dynamics of thermoelectric palladium sulfide 期刊论文 JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 798, 页码: 484 作者:  Chen, Liu-Cheng;  Peng, Qing;  Yu, Hao;  Pang, Hong-Jie;  Jiang, Bin-Bin 收藏  |  浏览/下载：53/0  |  提交时间：2019/12/26 Palladium sulfide  X-ray diffraction  Raman spectra  Ab initio calculations   Understanding the thermodynamic properties of 20% CeO2 stabilized ZrO2 coatings with atomistic modeling and simulations 期刊论文 MATERIALS RESEARCH EXPRESS, 2019, 卷号: 6, 期号: 7 作者:  Gul, Sahar Ramin;  Khan, Matiullah;  Zeng, Yi;  Wu, Bo 收藏  |  浏览/下载：42/0  |  提交时间：2019/12/26 20% CeO2 stabilized ZrO2  ab-initio calculations  thermal conductivity  thermal barrier coatings   Design of pentagonal NbX monolayers for electronics and electrocatalysis 期刊论文 APPLIED SURFACE SCIENCE, 2019, 卷号: 479, 页码: 595 作者:  Chen, Wenzhou;  Yang, Ming;  Sun, Yi-Yang;  Kawazoe, Yoshiyuki;  Shi, Xingqiang 收藏  |  浏览/下载：50/0  |  提交时间：2019/12/26 Two-dimensional materials  First-principles calculations  Electronics  Hydrogen evolution reaction   Understanding of role of Li in high-performance Pb-free Li-doped (Ba0.85Ca0.15)(Ti-0.9 Zr-0.1)O-3 piezoceramics from theory and experiments 期刊论文 MATERIALS CHEMISTRY AND PHYSICS, 2019, 卷号: 231, 页码: 173 作者:  Chen, Xiaoming;  Zeng, Jiangtao;  Kim, Dokyun;  Zheng, Liaoying;  Lou, Qiwei 收藏  |  浏览/下载：44/0  |  提交时间：2019/12/26 Lead-free ceramics  Activation energy  Phase transitions  Impurities  First-principles calculations   Nanoscale pores plus precipitates rendering high-performance thermoelectric SnTe1-xSex with refined band structures 期刊论文 NANO ENERGY, 2019, 卷号: 60, 页码: 1 作者:  Hong, Min;  Wang, Yuan;  Xu, Shengduo;  Shi, Xun;  Chen, Lidong 收藏  |  浏览/下载：56/0  |  提交时间：2019/12/26 Nanoscale pores  Phonon scatterings  Thermoelectrics  Molecular orbital theory  Density functional theory calculations   Investigation of mechanical and thermal properties of rare earth pyrochlore oxides by first-principles calculations 期刊论文 JOURNAL OF THE AMERICAN CERAMIC SOCIETY, 2019, 卷号: 102, 期号: 5, 页码: 2830 作者:  Yang, Lan;  Zhu, Changhua;  Sheng, Ye;  Nian, Hongqiang;  Li, Qian 收藏  |  浏览/下载：87/0  |  提交时间：2019/12/26 first-principles calculations  mechanical properties  pyrochlore  thermal conductivity   Structural phase transitions and superconductivity of YC2 from first-principles calculations 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 159, 页码: 120 作者:  Xue, Junling;  Guo, Yongliang;  Liu, Changdong;  Sun, Xinjun;  Qiu, Wujie 收藏  |  浏览/下载：50/0  |  提交时间：2019/12/26 First-principles calculations  Crystal structure prediction  High-pressure phase transition  Superconductivity   First-principles study of the vibrational characteristics of the heavy element substitution on Cu3SbSe3 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 156, 页码: 167 作者:  Xue, Junling;  Zhang, Wenqing;  Xi, Lili;  Guo, Yongliang;  Sun, Xinjun 收藏  |  浏览/下载：73/0  |  提交时间：2019/12/31 The lattice thermal conductivity (LTC)  Debye-Callaway model  Thermoelectric materials  First-principles calculations   Non-Conjugated Dicarboxylate Anode Materials for Electrochemical Cells 期刊论文 ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2018, 卷号: 57, 期号: 29, 页码: 8865, 8870 作者:  Ma, Chao;  Zhao, Xiaolin;  Kang, Litao;  Wang, Kai-Xue;  Chen, Jie-Sheng 收藏  |  浏览/下载：27/0  |  提交时间：2018/12/28 electrochemical performance  first-principles calculations  hydrogen bonding  organic anode materials  sodium-ion batteries