most citedHigh-throughput screening of heterogeneous transition metal dual-atom catalysts by synergistic effect for nitrate reduction to ammonia

151 citations · 326 across the 6 of their papers we have counts for

collaborators

6 papers

cond-mat.mtrl-sci2023★ 151 cited

High-throughput screening of heterogeneous transition metal dual-atom catalysts by synergistic effect for nitrate reduction to ammonia

Zheng Shu, Hongfei Chen, Xing Liu +3

Nitrate reduction to ammonia has attracted much attention for nitrate (NO3-) removal and ammonia (NH3) production. Identifying promising catalyst for active nitrate electroreductio…

cond-mat.mtrl-sci2023★ 10 cited

Thickness-dependent catalytic activity of hydrogen evolution based on single atomic catalyst of Pt above MXene

Zheng Shu, Yongqing Cai

Hydrogen as the cleanest energy carrier is a promising alternative renewable resource to fossil fuels. There is an ever-increasing interest in exploring efficient and cost-effectiv…

cond-mat.mtrl-sci2023★ 59 cited

High-performance Thermoelectric Monolayer γ-GeSe and its Group-IV Monochalcogenide Isostructural Family

Zheng Shu, Bowen Wang, Xiangyue Cui +4

Recently synthesized novel phase of germanium selenide (γ-GeSe) adopts a hexagonal lattice and a surprisingly high conductivity than graphite. This triggers great interests in expl…

physics.chem-ph2022★ 39 cited

Efficient Passivation of Surface Defects by Lewis Base in Lead-free Tin-based Perovskite Solar Cells

Hejin Yan, Bowen Wang, Xuefei Yan +5

Lead-free tin-based perovskites are highly appealing for the next generation of solar cells due to their intriguing optoelectronic properties. However, the tendency of Sn2+ oxidati…

cond-mat.mtrl-sci2022★ 20 cited

Fast Intercalation of Lithium in Semi-Metallic γ-GeSe Nanosheet: A New Group-IV Monochalcogenide for Lithium-Ion Battery Application

Zheng Shu, Xiangyue Cui, Bowen Wang +2

Existence of van der Waals gaps renders two-dimensional (2D) materials ideal passages of lithium for being used as anode materials. However, the requirement of good conductivity si…

cond-mat.mtrl-sci2022★ 47 cited

Mutual modulation via charge transfer and unpaired electrons of catalyt-ic site for superior intrinsic activity of N2 reduction: from high-throughput computations assisted with machine learning perspective

Zheng Shu, Hejin Yan, Hongfei Chen +1

Electrocatalysts of nitrogen reduction reaction (NRR) have attracted ever-growing attention due to its application for renewable energy alternative to fossil fuels. However, activa…