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352 积分 2024-11-01 加入
Janus-type monolayer M2SSe (M = Ga, In, B, and al) as sulfur host materials for lithium-sulfur batteries: A first-principles study
17天前
已完结
Regulating the coordination environment of single atom catalysts anchored on C3N monolayer for Li-S battery by first-principles calculations
25天前
已完结
Theory-guided optimization of coordination sites via d-band modulation for efficient single-atomic Li–S catalysis
25天前
已完结
A volcano correlation between catalytic activity and d band center regulated by the positions of P doping in Co SACs
25天前
已完结
Unraveling the Volcano-Type Relationship in Polysulfides Adsorption-Catalysis over MoS 2 for High-Performance Lithium–Sulfur Batteries
1个月前
已完结
Theory-guided optimization of coordination sites via d-band modulation for efficient single-atomic Li–S catalysis
1个月前
已完结
A linear correlation of p-band center with the performance of electrochemical CO2 reduction revealed by Sn single-atom catalysts
3个月前
已完结
Theory-guided optimization of coordination sites via d-band modulation for efficient single-atomic Li–S catalysis
3个月前
已完结
Density Functional Theory Studies on Tuning p-Band Electronic Structures of TiS2-Based Single-Atom Catalysts for Polysulfide Conversion in Lithium–Sulfur Batteries
3个月前
已完结
A linear correlation of p-band center with the performance of electrochemical CO2 reduction revealed by Sn single-atom catalysts
3个月前
已完结
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