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636 积分 2024-12-17 加入
Evaluation of the CO2 reduction reaction using Mn and Cr single atom catalysts implanted on the g-C3N4 (heptazine): A DFT study
16天前
已完结
Platinum single-atom anchored covalent organic framework for boosting photocatalytic CO2 reduction: A DFT study
1个月前
已关闭
First-principles calculations of photocatalytic water splitting on two-dimensional Janus ZrSSe/GaP heterojunction
1个月前
已完结
Impact of Crystal Orientations on the Circular and Linear Dichroism Signals in Chiral Perovskite
1个月前
已完结
Hypercoordinated Si/Ge Driving Excellent HER Catalytic Performance in New TM2X (X = Si and Ge) Monolayers: A High-Throughput Investigation by Screening Transition Metal Elements†
3个月前
已完结
Activation of efficient hydrogen evolution on 1T-VS2 nanoribbons by low-cost transition metals: A first-principles study
3个月前
已完结
Revealing the oxygen reduction reaction activity origin of single atoms supported on g-C3N4 monolayers: a first-principles study
3个月前
已完结
2D carbon nitrides: Regulating non-metal boron-doped C3N5 for elucidating the mechanism of wide pH range photocatalytic hydrogen evolution reaction
3个月前
已完结
Effects of heterogeneous non-precious metal and graphene composites on catalytic performance of hydrogen evolution reaction
3个月前
已完结
Dual main-group metal doping in covalent organic polymers boosts hydrogen evolution via interlayer coupling engineering: A machine learning aided density functional theory (DFT) investigation
3个月前
已完结
LAVR-289, an Orally Bioavailable Inhibitor of Adenovirus Replication In Vitro and In Vivo
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