Theoretical Study on the High HER/OER Electrocatalytic Activities of 2D GeSi, SnSi, and SnGe Monolayers and Further Improvement by Imposing Biaxial Strain or Doping Heteroatoms

Theoretical Investigation on the Hydrogen Evolution, Oxygen Evolution, and Oxygen Reduction Reactions Performances of Two-Dimensional Metal-Organic Frameworks Fe3(C2X)12 (X = NH, O, S)

(2022) Xiaohang Yang et al.   MOLECULES

Tetragonal transition metal selenide for hydrogen evolution

(2022) B.B. Xiao et al.   APPLIED SURFACE SCIENCE

Activating Sulfur Sites of CoS2 Electrocatalysts through Tin Doping for Hydrogen Evolution Reaction

(2021) Fang Liu et al.   APPLIED SURFACE SCIENCE

Ligand Exchange Reaction in [Co4O4]-Cobalt Cubane: a Versatile Strategy Towards the Preparation of Cobalt Cubane-based Functional Small Molecules and Polymeric Materials

(2021) Muhammad Waqas Ishaq et al.   JOURNAL OF MOLECULAR STRUCTURE

Nanoscale CuTe electrocatalyst immobilized at conductor surface for remarkable hydrogen evolution reaction

(2021) Qudrat Ullah Khan et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Machine Learning for Transition-Metal-Based Hydrogen Generation Electrocatalysts

(2021) Min Wang et al.   ACS Catalysis

Advanced Transition Metal‐Based OER Electrocatalysts: Current Status, Opportunities, and Challenges

(2021) Kexin Zhang et al.   Small

MXenes modified by single transition metal atom for hydrogen evolution reaction catalysts

(2021) Zhe Meng et al.   APPLIED SURFACE SCIENCE

Increasing Silicon Concentration and Doping Heteroatom to Successfully Realize High HER Catalytic Activity in 2D Metal-Free BSi n (n = 1–4) Structures: A First-Principles Study

(2021) Cuimei Li et al.   JOURNAL OF THE ELECTROCHEMICAL SOCIETY

Novel 2D Transition‐Metal Carbides: Ultrahigh Performance Electrocatalysts for Overall Water Splitting and Oxygen Reduction

(2020) Yadong Yu et al.   ADVANCED FUNCTIONAL MATERIALS

Multifunctional electrocatalytic activity of coronene-based two-dimensional metal-organic frameworks: TM-PTC

(2020) Juan Wang et al.   APPLIED SURFACE SCIENCE

Bifunctional HER/OER or OER/ORR Catalytic Activity of Two-Dimensional TM3(HITP)2 with TM = Fe–Zn

(2020) Junru Wang et al.   Journal of Physical Chemistry C

Stable Multifunctional Single-Atom Catalysts Resulting from the Synergistic Effect of Anchored Transition-Metal Atoms and Host Covalent–Organic Frameworks

(2020) Juan Wang et al.   Journal of Physical Chemistry C

Carbon-based electrocatalysts for sustainable energy applications

(2020) Jian Wang et al.   PROGRESS IN MATERIALS SCIENCE

Non‐N‐Doped Carbons as Metal‐Free Electrocatalysts

(2020) Bin Wang et al.   Advanced Sustainable Systems

Recent Progress of Two‐Dimensional Metal‐Organic Frameworks and Their Derivatives for Oxygen Evolution Electrocatalysis

(2020) Wei Huang et al.   ChemElectroChem

Colloidal Ni2P Nanocrystals Encapsulated in Heteroatom-Doped Graphene Nanosheets: A Synergy of 0D@2D Heterostructure Toward Overall Water Splitting

(2020) Umesh P. Suryawanshi et al.   CHEMISTRY OF MATERIALS

Light metal functionalized two-dimensional siligene for high capacity hydrogen storage: DFT study

(2020) Akari Narayama Sosa et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

The crucial role of strained ring in enhancing the hydrogen evolution catalytic activity for the 2D carbon allotropes: a high-throughput first-principles investigation

(2019) Jingwei Liu et al.   2D Materials

Accelerated Hydrogen Evolution Reaction in CoS2 by Transition-Metal Doping

(2018) Jingyan Zhang et al.   ACS Energy Letters

Batteries and fuel cells for emerging electric vehicle markets

(2018) Zachary P. Cano et al.   Nature Energy

Graphene Defects Trap Atomic Ni Species for Hydrogen and Oxygen Evolution Reactions

(2018) Longzhou Zhang et al.   Chem

The mechanism of hydrogen adsorption on transition metal dichalcogenides as hydrogen evolution reaction catalyst

(2017) Jinsong Wang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Edge-selectively phosphorus-doped few-layer graphene as an efficient metal-free electrocatalyst for the oxygen evolution reaction

(2016) Zhaohui Xiao et al.   CHEMICAL COMMUNICATIONS

SiTe monolayers: Si-based analogues of phosphorene

(2016) Yu Chen et al.   Journal of Materials Chemistry C

Design of electrocatalysts for oxygen- and hydrogen-involving energy conversion reactions

(2015) Yan Jiao et al.   CHEMICAL SOCIETY REVIEWS

Designing an improved transition metal phosphide catalyst for hydrogen evolution using experimental and theoretical trends

(2015) Jakob Kibsgaard et al.   Energy & Environmental Science

Bifunctional non-noble metal oxide nanoparticle electrocatalysts through lithium-induced conversion for overall water splitting

(2015) Haotian Wang et al.   Nature Communications

Metal-free B-doped graphene with efficient electrocatalytic activity for hydrogen evolution reaction

(2014) Bhaskar R. Sathe et al.   Catalysis Science & Technology

Opportunities and challenges for a sustainable energy future

(2012) Steven Chu et al.   NATURE

Electrocatalyst approaches and challenges for automotive fuel cells

(2012) Mark K. Debe   NATURE

Universality in Oxygen Evolution Electrocatalysis on Oxide Surfaces

(2011) Isabela C. Man et al.   ChemCatChem

Graphene based new energy materials

(2011) Yiqing Sun et al.   Energy & Environmental Science

Enhancing Hydrogen Evolution Activity in Water Splitting by Tailoring Li+-Ni(OH)2-Pt Interfaces

(2011) R. Subbaraman et al.   SCIENCE

Electrocatalytic Activity and Stability of Nitrogen-Containing Carbon Nanotubes in the Oxygen Reduction Reaction

(2009) Shankhamala Kundu et al.   Journal of Physical Chemistry C

Monolayer honeycomb structures of group-IV elements and III-V binary compounds: First-principles calculations

(2009) H. Şahin et al.   PHYSICAL REVIEW B

Oxidation and Photo-Oxidation of Water on TiO2 Surface

(2008) Á. Valdés et al.   Journal of Physical Chemistry C

Surface Pourbaix diagrams and oxygen reduction activity of Pt, Ag and Ni(111) surfaces studied by DFT

(2008) Heine A. Hansen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS