Theoretical prediction of the structural, mechanical, hydrogen storage, dynamic, thermodynamic and photoelectronic properties of new Al-based hydrides X2AlH6 (X = K, Rb) for hydrogen storage applications

作者：Jiapei Chen, Shijie Zhang, Shanjun Chen, Yan Chen, Jie Hou, Zhifeng Yin, Haijun Hou · 发表于：Journal of Physics and Chemistry of Solids · 年份：2025 · DOI：10.1016/j.jpcs.2025.113345 · 被引用次数：11 · 研究领域：Hydrogen Storage and Materials、Boron and Carbon Nanomaterials Research、Cellular and Composite Structures