科研成果 - 吴 震
论文标题 | First-principles insights into influencing mechanisms of metalloid B on Mg-based hydrides |
作者 | Zhen Wu, Luying Zhu, Fusheng Yang, Zhao Jiang, Zaoxiao Zhang* |
发表/完成日期 | 2017-02-05 |
期刊名称 | Journal of Alloys and Compounds |
期卷 | 693 |
相关文章 | |
论文简介 | •B-doped Mg-based hydrogen storage system is designed based on density functional theory. •Nonmetal B has better improvement effect than most of transition metals for Mg-based system. •Desorption temperature is reduced to less than 80 °C, the ultimate goal of US DOE. •It provides new insights into the light nonmetal-doped Mg-based hydrogen storage materials. |