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30 积分 2025-12-01 加入
First-principle quantum analysis of structural, electronic, optical, and mechanical properties of K3XH8 (X = Cr, Mn and Fe) hydrides for hydrogen storage system
3天前
已完结
First-principles insights into NaScQH6 (Q = Fe, Ru, Os): Promising high-density hydrogen storage materials
6天前
已完结
Comprehensive first-principles analysis on rare earth complex hydrides LiABH6 (A= Sc, Y; B = Fe, Ru, Os): A promising class of hydrogen storage materials
6天前
已完结
Emergent multifunctionality in the two-dimensional Janus VSBrI monolayer: A study of multiferroicity, magnetoelectricity, and piezoelectricity
17天前
已完结
Multifunctional double perovskites Cs2BI6 (B = Ti, Ge, Se, Sn, and Te) for solar energy harvesting: photovoltaic, photocatalytic, and thermoelectric pathways
25天前
已完结
Exploring the hydrogen storage potential of lead-free rubidium based perovskite hydrides: A first-principles study
26天前
已完结
Strain matters: Enhancing the hydrogenation properties of Mg₂CoH₅ through multiaxial approaches
1个月前
已完结
The effect of strain on hydrogen storage characteristics in K2NaAlH6 double perovskite hydride through first principle method
1个月前
已完结
Triaxial strain effects on hydrogen storage capacity of KMgH3: A computational study
1个月前
已完结
Hydrogen storage of Mg1−xMxH2(M= Ti, V, Fe) studied using first-principles calculations
1个月前
已完结
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