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浏览/检索结果: 共6条，第1-6条 帮助 限定条件 发表日期：2022     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 First-principles study of the structural, electronic, dynamical, and mechanical properties of Pd-Nb binary systems 期刊论文 CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2022, 卷号: 78, 页码: 12 作者:  Liu, Mingfeng;  Wang, Lei;  Wang, Jiantao;  Zhu, Heyu;  Ma, Hui 收藏  |  浏览/下载：36/0  |  提交时间：2022/09/16 First-principles calculations  Variable-composition evolutionary structure search  Pd-Nb binary system  Intermetallics  Electronic structures  Elastic properties   Exploring the effects of temperature-driven phase transition on supercapacitive performance of cobalt diselenide 期刊论文 JOURNAL OF POWER SOURCES, 2022, 卷号: 541 作者:  Li, Mingjie;  Liu, Weizhe;  Ju, Jiaming;  Xie, Lixiang;  Chen, Yuhong 收藏  |  浏览/下载：28/0  |  提交时间：2022/07/19 Cobalt diselenide  Phase transition  Supercapacitor  Density function theory   First-principles study of helium-vacancy complexes in Be12Ti 期刊论文 PHYSICS LETTERS A, 2022, 卷号: 424, 页码: 6 作者:  Zhu, Xiaolu;  Zhang, Yaowen;  Tang, Wei;  Meng, Zhaocang;  Li, Wentao 收藏  |  浏览/下载：17/0  |  提交时间：2022/04/11 First-principles calculations  He-vacancy complexes  Vacancy trapping  Be12Ti   Catalytic Performance of Amorphous Alloy in Wastewater Treatment 期刊论文 Cailiao Daobao/Materials Reports, 2022, 卷号: 36, 期号: 2 作者:  Pei, Liefei;  Zhang, Xiangyun;  Yuan, Zizhou 收藏  |  浏览/下载：34/0  |  提交时间：2022/04/21 Activation energy  Amorphous alloys  Azo dyes  Catalysis  Catalyst activity  Copper alloys  Electron transport properties  Heavy metals  Leaching  Passivation  Rate constants  Redox reactions  Reusability  Wastewater treatment  Azo-dyes  Catalytic performance  Degradation agents  Degradation efficiency  Dyes wastewaters  Printing and dyeing  Reaction activity  Source of waters  Zero-valent iron  ]+ catalyst   Toward the Rational Design of Mid-Infrared Nonlinear Optical Materials with Targeted Properties via a Multi-Level Data-Driven Approach 期刊论文 ADVANCED FUNCTIONAL MATERIALS, 2022, 卷号: 32, 期号: 23, 页码: 1-9 作者:  Cai, WB (Cai, Wenbing) [1];  Abudurusuli, A (Abudurusuli, Ailijiang) [1] , [2];  Xie, CW (Xie, Congwei) [1];  Tikhonov, E (Tikhonov, Evgenii) [1];  Li, JJ (Li, Junjie) [1] , [2] 收藏  |  浏览/下载：31/0  |  提交时间：2022/06/21 crystal structure prediction  high-throughput computation and screening  machine learning  nonlinear optical material  second harmonic generation response   Doping in the two-dimensional limit: p/n-type defects in monolayer ZnO 期刊论文 Physical Review B, 2022, 卷号: 105, 期号: 2, 页码: 7 作者:  D. Han;  X. B. Li;  D. Wang;  N. K. Chen and X. W. Fan 收藏  |  浏览/下载：0/0  |  提交时间：2023/06/14