Materials for hydrogen-based energy storage: Past, recent progress and future outlook
Volodymyr A. Yartys, Marcello Baricco, Jose Bellosta von Colbe, Didier Blanchard, Robert C. Bowman, Darren P. Broom, Craig E. Buckley, Fei Chang, Ping Chen, You… 展开作者
Volodymyr A. Yartys, Marcello Baricco, Jose Bellosta von Colbe, Didier Blanchard, Robert C. Bowman, Darren P. Broom, Craig E. Buckley, Fei Chang, Ping Chen, Young Whan Cho, Jean-Claude Crivello, Fermin Cuevas, William I. F. David, Petra E. de Jongh, Roman V. Denys, Martin Dornheim, Michael Felderhoff, Yaroslav Filinchuk, George E. Froudakis, David M. Grant, Bjørn C. Hauback, Ladislav Havela, Teng He, Michael Hirscher, Terry D. Humphries, Torben R. Jensen, Sangryun Kim, Yoshitsugu Kojima, Michel Latroche, Hai-Wen Li, Mykhaylo V. Lototskyy, Joshua W. Makepeace, Kasper T. Møller, Lubna Naheed, Peter Ngene, Dag Noréus, Magnus Moe Nygård, Shin-ichi Orimo, Mark Paskevicius, Luca Pasquini, Dorthe B. Ravnsbæk, M. Veronica Sofianos, Terrence J. Udovic, Tejs Vegge, Gavin S. Walker, Colin J. Webb, Claudia Weidenthaler, Claudia Zlotea
发表信息：
Journal of Alloys and Compounds Volume 827, 25 June 2020, 153548
氢化镁在固体储氢材料方面占有最大的份额。为IEA Task 32 Hydrogen Based Energy Storage做出贡献的国际镁专家组最近发表了两篇综述论文，介绍了该小组的活动重点是氢化镁基材料和用于氢和能量存储的镁基化合物。这篇综述文章不仅概述了镁基复合材料的基本方面及其应用的最新活动，而且还介绍了该主题的历史概述，并概述了未来的发展。重点介绍了Mg-H体系在极压下的理论和实验研究、MgH 2体系的动力学和热力学研究、纳米结构研究、新型镁基化合物和新型复合材料研究以及镁基储氢体系中的催化作用研究。最后，热能存储和放大氢存储系统容纳MgH 2。
英文摘要：
Magnesium hydride owns the largest share of publications on solid materials for hydrogen storage. The Magnesium group of international experts contributing to IEA Task 32 Hydrogen Based Energy Storage recently published two review papers presenting the activities of the group focused on magnesium hydride based materials and on Mg based compounds for hydrogen and energy storage. This review article not only overviews the latest activities on both fundamental aspects of Mg-based hydrides and their applications, but also presents a historic overview on the topic and outlines projected future developments. Particular attention is paid to the theoretical and experimental studies of Mg-H system at extreme pressures, kinetics and thermodynamics of the systems based on MgH2,nanostructuring, new Mg-based compounds and novel composites, and catalysis in the Mg based H storage systems. Finally, thermal energy storage and upscaled H storage systems accommodating MgH2 are presented.
High-Entropy Hydrides for Fast and Reversible Hydrogen Storage at Room Temperature: Binding-Energy Engineering via First-Principles Calculations and Experiments
Lithium and sodium decorated PHE-graphene for high capacity hydrogen storage: A DFT and GCMC study
Jiangsu Provincial Engineering Research Center of Low-Dimensional Physics and New Energy, College of Science, Nanjing University of Posts and Telecommunications（南京邮电大学理学院低维物理与新能源江苏省工程研究中心）
Structural phase stability, electronic structure, magnetic properties and chemical bonding analysis of transition metal ammine borohydrides with amphoteric hydrogen for hydrogen storage
Balancing Thermodynamics, Kinetics, and Reversibility in Ti-Doped MgB2H8: A First-Principles Assessment of a Practical Solid-State Hydrogen Storage Material
New Technologies Research Center, University of West Bohemia（新技研究中心，西波希米亚大学）；Department of Physics, Bacha Khan University（巴哈汗大学物理系）
Digital Hydrogen Platform (DigHyd): A Rigorously Curated Database for Hydrogen Storage Materials Empowered by AI-Assisted Literature Mining
Advanced Institute for Materials Research (WPI-AIMR), Tohoku University（东北大学材料高等研究所）；Frontier Research Institute for Interdisciplinary Sciences (FRIS), Tohoku University（东北大学前沿跨学科科学研究院）；Department of Materials Engineering, The University of Tokyo（东京大学材料工学科）；Institute for Materials Research, Tohoku University（东北大学物质材料研究所）；Institute of Fluid Science, Tohoku University（东北大学流体科学研究所）
Machine learning via artificial neural networks coupled with density functional theory and experiments for thermodynamic optimization of high-entropy alloys for hydrogen storage at room temperature
WPI, International Institute for Carbon-Neutral Energy Research (WPI-I2CNER), Kyushu University（九州大学）；Department of Automotive Science, Graduate School of Integrated Frontier Sciences, Kyushu University（九州大学）；Institute for Materials Science, University of Stuttgart（斯图加特大学）
Oxidation-resilient structural modifications in Nickel-functionalized 3D-graphene for hydrogen storage applications
Istituto Nanoscienze–CNR（意大利国家研究委员会纳米科学研究所）；NEST-Scuola Normale Superiore（新实验科学与技术学院-高等师范学校）；Department of Physical Science, Earth, and Environment, University of Siena（锡耶纳大学地球与环境物理科学系）；Institute of Sensor and Actuator Systems, TU Wien（维也纳工业大学传感器与致动器系统研究所）；CNR - Istituto Officina dei Materiali (IOM)（意大利国家研究委员会材料工厂研究所）
Hydrogen Storage Performance Enhancement and Bandgap Opening of M-Decorated ($\mathrm{M}=\mathrm{Li}$, Na and K) III\textsubscript{4}-V\textsubscript{4} Monolayer by Fluorine Functionalization
Electric Field Enhanced Hydrogen Storage on BN Sheet
使用密度泛函理论，我们表明，施加的电场通过极化氢分子以及基板，大大提高了BN片的储氢性能。在0.05 a. u.的电场存在下单个H2分子的吸附能。是0.48 eV，而在其不存在时为0.07 eV。当吸附一层H2分子时，每个H2分子的结合能从无场情况下的0.03 eV增加到存在0.045 a. u的电场时的0.14 eV/H2。7.5wt%的相应重量密度与DOE为2010年设定的6wt%系统目标一致。一旦去除所施加的电场，存储的H2分子可以容易地释放，从而使存储可逆。
