Lv12
40 积分 2025-10-03 加入
DFT Investigation of Two-Dimensional Borospherene for Sensing and Capture of Toxic Gases
3小时前
待确认
Theoretical investigation of sodium-decorated B5N3 boron nitride monolayer for hydrogen storage: A DFT study
18小时前
已完结
Evaluation of alkali metal-decorated BeC monolayers as reversible hydrogen storage media by first-principles calculations
3天前
已完结
Stabilizing Lithium-Rich Li1.2Ni0.13Mn0.54Co0.13O2 Cathode via Fast-Ionic Li3AlF6 Surface Coating
6天前
已完结
High-Capacity Reversible Hydrogen Storage in Yttrium-Decorated 2D Polyaramid: Adsorption and Desorption Mechanism from DFT Simulations
7天前
已完结
Zr-Decorated Synthesized 2D Aza-Triphenylene for High-Capacity Hydrogen Storage: Insights from DFT Simulations
7天前
已完结
DFT-D3 and AIMD investigation of hydrogen storage in the Li-decorated carbon-doped BN analogue of 8-16-4 graphyne
16天前
已完结
Structural, electronic, and hydrogen storage properties of pristine and Mn-decorated TH-graphyne: A DFT-D2 perspective
1个月前
已完结
Theoretical design of NbS2 based bifunctional single transition metal atom catalysts for overall water splitting
1个月前
已完结
Superalkali NLi4 functionalized 2D-BeN4 as a promising hydrogen storage medium: An ab initio DFT and AIMD investigations
1个月前
已完结
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