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View article: High‐Performance NIR‐II Sn‐Based Perovskite LEDs Enabled by the Functionalization of Sulfaguanidine
High‐Performance NIR‐II Sn‐Based Perovskite LEDs Enabled by the Functionalization of Sulfaguanidine Open
Eco‐friendly CsSnI 3 ‐based perovskite light‐emitting diodes (PeLEDs) with the emission peak extending to the near‐infrared‐II (NIR‐II) region hold tremendous potential for applications in biological monitoring, night vision, and optical c…
View article: Modulating Binding Strength and Acidity of Benzene‐Derivative Ligands Enables Efficient and Hysteresis‐Free Perovskite/Silicon Tandem Solar Cells
Modulating Binding Strength and Acidity of Benzene‐Derivative Ligands Enables Efficient and Hysteresis‐Free Perovskite/Silicon Tandem Solar Cells Open
Passivating defects at the wide‐bandgap perovskite/C 60 interface without impeding interfacial charge transport can effectively enhance the efficiency of perovskite/silicon tandem solar cells (TSCs). Herein, we study the impact of benzene‐…
View article: AI in single-atom catalysts: a review of design and applications
AI in single-atom catalysts: a review of design and applications Open
Single-atom catalysts (SACs) have emerged as a research frontier in catalytic materials, distinguished by their unique atom-level dispersion, which significantly enhances catalytic activity, selectivity, and stability. SACs demonstrate sub…
View article: Employing Octahedral Net Charge Descriptors for Designing High‐Performance Aqueous Proton Batteries
Employing Octahedral Net Charge Descriptors for Designing High‐Performance Aqueous Proton Batteries Open
Recently, aqueous proton batteries have shown promise for electrochemical energy storage using MXene electrodes. However, designing high‐performance MXene proton batteries remains challenging due to the inevitable hydrogen evolution reacti…
View article: The Electrocatalytic Role of Oxygen Vacancy in Nitrate Reduction Reactions
The Electrocatalytic Role of Oxygen Vacancy in Nitrate Reduction Reactions Open
Ammonia, with high energy density and easy transportation, holds significant potential to become an integral part of future energy systems. Among tremendous strategies, electrocatalytic ammonia production is no doubt an efficient and eco-f…
View article: Revealing the Adsorption Behavior of Nitrogen Reduction Reaction on Strained Ti<sub>2</sub>CO<sub>2</sub> by a Spin‐Polarized <i>d</i>‐band Center Model (Small 9/2024)
Revealing the Adsorption Behavior of Nitrogen Reduction Reaction on Strained Ti<sub>2</sub>CO<sub>2</sub> by a Spin‐Polarized <i>d</i>‐band Center Model (Small 9/2024) Open
Nitrogen Reduction Reaction In article number 2306840, Jun Fan and co-workers showed that tensile strain tuning the oxidation states of Ti and favoring O-vacancy formation in Ti2CO2 enhances electrochemical dinitrogen reduction. The downsh…
View article: First-Principles Study of FeB<sub>2</sub>Monolayers as High-Capacity Electrode Materials for Mg-Ion Batteries
First-Principles Study of FeB<sub>2</sub>Monolayers as High-Capacity Electrode Materials for Mg-Ion Batteries Open
Rechargeable Mg-ion batteries (MIBs) have attracted extensive attention due to the abundance of magnesium resources and huge superiority in energy density. But the lack of suitable electrode materials hinders the realization of MIBs. Herei…
View article: B<sub>5</sub>N<sub>3</sub>as a potential high-capacity electrode material for calcium ion batteries
B<sub>5</sub>N<sub>3</sub>as a potential high-capacity electrode material for calcium ion batteries Open
B 5 N 3 exhibits an ultra-high capacity of 4463 mA h g −1 and a low open circuit voltage of 0.1 V as a calcium ion battery (CIB) electrode material.
View article: S-functionalized 2D V<sub>2</sub>B as a promising anode material for rechargeable lithium ion batteries
S-functionalized 2D V<sub>2</sub>B as a promising anode material for rechargeable lithium ion batteries Open
V 2 BS 2 is a promising anode material for lithium-ion batteries due to its excellent electrochemical performance.
View article: Work function regulation of surface-engineered Ti<sub>2</sub>CT<sub>2</sub>MXenes for efficient electrochemical nitrogen reduction reaction
Work function regulation of surface-engineered Ti<sub>2</sub>CT<sub>2</sub>MXenes for efficient electrochemical nitrogen reduction reaction Open
The synergetic effect of surficial vacancy and transition metals was unrevealed in defective Ti 2 CT 2 (T = O, F, H, OH) systems, and work function provided an alternative view of designing efficient NRR electrocatalysts.
View article: Theoretical design of high-performance halogen anion batteries with MXene electrodes: influence of functional groups, metals, and anions
Theoretical design of high-performance halogen anion batteries with MXene electrodes: influence of functional groups, metals, and anions Open
13 stable models were screened from 36 halogen anion batteries with MXene electrodes, exhibiting remarkable electrochemical performance.