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浏览/检索结果: 共261条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择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作者升序作者降序 Two-dimensional Pt@g-C3N4/ReS2 Van Der Waals Heterostructure for photocatalytic hydrogen evolution with direct Z-scheme 期刊论文  OAI收割 CHEMICAL PHYSICS LETTERS, 2025, 卷号: 870, 页码: 142101 作者:  Wang, Hong-Yao;  Yang, Chuan-Lu;  Li, Xiaohu;  Liu, Yuliang;  Zhao, Wenkai   |  收藏  |  浏览/下载：2/0  |  提交时间：2025/07/07 Heterostructure  Photocatalytic  Direct Z -scheme  Solar-to-hydrogen  Gibbs free energy   Free Energy Criterion for Thermal Stability of Schwarz Nanocrystals 期刊论文  OAI收割 NANO LETTERS, 2025, 卷号: 25, 期号: 19, 页码: 8058-8063 作者:  Lei T(雷挺);  Liu F(刘峰);  Wu XL(武晓雷);  Wang YJ(王云江)   |  收藏  |  浏览/下载：2/0  |  提交时间：2025/06/23 Schwarz nanocrystal  thermal stability  free energy  minimal surface grain boundary  coherenttwin boundary   AAl2Se4/XSe2 (A= Cd, Hg; X= Ti, Zr, Hf) heterostructures for photocatalytic overall water splitting with Z-scheme: Insight from nonadiabatic dynamics simulation and Gibbs free energy 期刊论文  OAI收割 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 92, 页码: 124-135 作者:  Sun, Hao;  Yang, Chuan-Lu;  Li, Xiaohu;  Liu, Yuliang;  Zhao, Wenkai   |  收藏  |  浏览/下载：2/0  |  提交时间：2024/11/27 Solar-to-hydrogen  Photocatalytic  Direct Z -scheme  Gibbs free energy  Nonadiabatic dynamics   First-principles study on the Te/Po doped SrTiO3 (100) surface for photocatalytic overall water splitting to produce hydrogen 期刊论文  OAI收割 SURFACES AND INTERFACES, 2024, 卷号: 51, 页码: 104645 作者:  Wang, Fei;  Yang, Chuan-Lu;  Li, Xiao-Hu;  Liu, Yu-Liang;  Zhao, Wen-Kai   |  收藏  |  浏览/下载：2/0  |  提交时间：2024/08/19 Hydrogen evolution reaction  Dope  Photocatalytic  Water splitting  Gibbs free energy   Flexible and Reabsorption-Free Perovskite Scintillators for Low-Dose X-ray Detection and High-Resolution Imaging 期刊论文  OAI收割 ACS PHOTONICS, 2024 作者:  Wang, Zhouyuanhang;  Li, Siqi;  Ren, Gang;  Yao, Shuyi;  Zhu, Dexiang   |  收藏  |  浏览/下载：12/0  |  提交时间：2024/11/22 perovskite scintillators  reabsorption-free  energy transfer  flexible   Local Isomeric Polar Nanoclusters Enabled Superior Capacitive Energy Storage Under Moderate Fields in NaNbO3-Based Lead-Free Ceramics 期刊论文  OAI收割 SMALL, 2024, 页码: 10 作者:  Xie, Aiwen;  Hu, Tengfei;  Lei, Junwei;  Zhang, Yi;  Wei, Xianbin   |  收藏  |  浏览/下载：31/0  |  提交时间：2024/07/12 energy storage  lead-free ceramics  NaNbO3  polar nanoclusters  relaxor ferroelectrics   Efficient photocatalytic overall water splitting for hydrogen evolution and CO2 reduction with SiCP4 allotrope monolayers 期刊论文  OAI收割 APPLIED SURFACE SCIENCE, 2024, 卷号: 654, 页码: 159440 作者:  Yin, Yi-Tong;  Yang, Chuan-Lu;  Li, Xiao-Hu;  Liu, Yu-Liang;  Zhao, Wen -Kai   |  收藏  |  浏览/下载：2/0  |  提交时间：2024/05/23 Allotropes  Stability  STH  Gibbs free energy  CO 2 reduction   Hydrogen generation from direct Z-scheme for photocatalytic overall water splitting with the SiSe/SnSe2 and SiSe/SnSSe heterostructures 期刊论文  OAI收割 JOURNAL OF CATALYSIS, 2024, 卷号: 432, 页码: 115429 作者:  Wang, Fei;  Yang, Chuan-Lu;  Li, Xiao-Hu;  Liu, Yu-Liang;  Zhao, Wen-Kai   |  收藏  |  浏览/下载：1/0  |  提交时间：2024/07/02 Solar-to-hydrogen  Direct Z-scheme  Hydrogen evolution reaction  Photocatalytic  Gibbs free energy  Nonadiabatic molecular dynamics simulation   Prediction of chemical short-range order in high-/medium-entropy alloys 期刊论文  OAI收割 JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2024, 卷号: 169, 页码: 115-123 作者:  Cao, Pei-Yu;  Wang, Jing;  Jiang, Ping;  Wang, Yun-Jiang;  Yuan, Fu-Ping   |  收藏  |  浏览/下载：78/0  |  提交时间：2023/10/10 Short-range order  High-entropy alloy  Microstructure  First-principles calculation  Gibbs free energy  Local electronic density of states   Discovery of hematopoietic progenitor kinase 1 inhibitors using machine learning-based screening and free energy perturbation 期刊论文  OAI收割 JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2024, 页码: 13 作者:  Feng, Dazhi;  Liu, Bo;  Chen, Zhiwei;  Xu, Jinyi;  Geng, Meiyu   |  收藏  |  浏览/下载：51/0  |  提交时间：2024/02/27 HPK1 inhibitor  machine learning  virtual screening  free energy perturbation  structural modification