Predicted Electrocatalyst Properties on Metal Insulator MoTe2 for Hydrogen Evolution Reaction and Oxygen Reduction Reaction Application in Fuel Cells

Mechanistic Study of Efficient Producing CO2 Electroreduction via 2D Metal-Organic Frameworks M3(2,3,6,7,10,11-hexaiminotriphenylene)2 Surface

(2021) Yi Xiao et al.   ELECTROCHIMICA ACTA

Theoretical insights into the selective and activity of CuAu catalyst for O2 and CO2 electroreduction

(2021) Yi Xiao et al.   COMPUTATIONAL MATERIALS SCIENCE

Theoretical scanning of bimetallic alloy for designing efficient N2 electroreduction catalyst

(2021) R. Chen et al.   Materials Today Energy

Mechanism of Electrocatalytically Active Precious Metal (Ni, Pd, Pt, and Ru) Complexes in the Graphene Basal Plane for ORR Applications in Novel Fuel Cells

(2020) Weibin Zhang et al.   ENERGY & FUELS

High-Throughput Approach Exploitation: Two-Dimensional Double-Metal Sulfide (M2S2) of Efficient Electrocatalysts for Oxygen Reduction Reaction in Fuel Cells

(2020) Yi Xiao et al.   ENERGY & FUELS

FeRh and Nitrogen Codoped Graphene, a Highly Efficient Bifunctional Catalyst toward Oxygen Reduction and Oxygen Evolution Reactions

(2020) Yanan Meng et al.   Journal of Physical Chemistry C

One-pot synthesis of non-precious metal RGO/1Tʹ-MoTe2: Cu heterohybrids for excellent catalytic hydrogen evolution

(2020) H.-Y. He et al.   Materials Science and Engineering B-Advanced Functional Solid-State Materials

Hybrid catalyst with monoclinic MoTe2 and platinum for efficient hydrogen evolution

(2019) Jinbong Seok et al.   APL Materials

Improved Oxygen Reduction Activity in Heteronuclear FeCo-Codoped Graphene: A Theoretical Study

(2019) Yanan Meng et al.   ACS Sustainable Chemistry & Engineering

van der Waals Metallic Transition Metal Dichalcogenides

(2018) Gang Hee Han et al.   CHEMICAL REVIEWS

Exploring Two-Dimensional Materials toward the Next-Generation Circuits: From Monomer Design to Assembly Control

(2018) Mengqi Zeng et al.   CHEMICAL REVIEWS

Origin of enhanced catalytic activity of oxygen reduction reaction on zirconium oxynitrides: A first-principle study

(2018) Guangjin Wang et al.   SOLID STATE IONICS

High-Throughput Screening and Automated Processing toward Novel Topological Insulators

(2018) Zeying Zhang et al.   Journal of Physical Chemistry Letters

Assessing DFT-D3 Damping Functions Across Widely Used Density Functionals: Can We Do Better?

(2017) Jonathon Witte et al.   Journal of Chemical Theory and Computation

Topological quantum catalyst: Dirac nodal line states and a potential electrocatalyst of hydrogen evolution in the TiSi family

(2017) Jiangxu Li et al.   Science China-Materials

2D transition metal dichalcogenides

(2017) Sajedeh Manzeli et al.   Nature Reviews Materials

Topological nodal line semimetals

(2016) Chen Fang et al.   Chinese Physics B

Functional Independent Scaling Relation for ORR/OER Catalysts

(2016) Rune Christensen et al.   Journal of Physical Chemistry C

Potential Application of Novel Boron-Doped Graphene Nanoribbon as Oxygen Reduction Reaction Catalyst

(2016) Lu Wang et al.   Journal of Physical Chemistry C

Emergent phenomena induced by spin–orbit coupling at surfaces and interfaces

(2016) Anjan Soumyanarayanan et al.   NATURE

Controlling phase transition for single-layer MTe2 (M = Mo and W): modulation of the potential barrier under strain

(2016) H. H. Huang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Structure and Electron-Transport Properties of Anion-Deficient MoTe2: A Combined Experimental and Theoretical Study

(2016) Manoj K. Jana et al.   ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE

Iron-embedded boron nitride nanosheet as a promising electrocatalyst for the oxygen reduction reaction (ORR): A density functional theory (DFT) study

(2015) Li-yan Feng et al.   JOURNAL OF POWER SOURCES

Landau level quantization and almost flat modes in three-dimensional semimetals with nodal ring spectra

(2015) Jun-Won Rhim et al.   PHYSICAL REVIEW B

Topological Node-Line Semimetal and Dirac Semimetal State in AntiperovskiteCu3PdN

(2015) Rui Yu et al.   PHYSICAL REVIEW LETTERS

Weyl Semimetal Phase in Noncentrosymmetric Transition-Metal Monophosphides

(2015) Hongming Weng et al.   Physical Review X

Molecular beam epitaxy of the van der Waals heterostructure MoTe2on MoS2: phase, thermal, and chemical stability

(2015) Horacio Coy Diaz et al.   2D Materials

Emerging Device Applications for Semiconducting Two-Dimensional Transition Metal Dichalcogenides

(2014) Deep Jariwala et al.   ACS Nano

Space-Confined Growth of MoS2 Nanosheets within Graphite: The Layered Hybrid of MoS2 and Graphene as an Active Catalyst for Hydrogen Evolution Reaction

(2014) Xiaoli Zheng et al.   CHEMISTRY OF MATERIALS

Optical Properties and Band Gap of Single- and Few-Layer MoTe2 Crystals

(2014) Claudia Ruppert et al.   NANO LETTERS

Quantum spin Hall effect in two-dimensional transition metal dichalcogenides

(2014) X. Qian et al.   SCIENCE

Observation of Fermi arc surface states in a topological metal

(2014) S.-Y. Xu et al.   SCIENCE

Observation of a three-dimensional topological Dirac semimetal phase in high-mobility Cd3As2

(2014) Madhab Neupane et al.   Nature Communications

Functionalization of Monolayer h-BN by a Metal Support for the Oxygen Reduction Reaction

(2013) Andrey Lyalin et al.   Journal of Physical Chemistry C

Weyl points and line nodes in gyroid photonic crystals

(2013) Ling Lu et al.   Nature Photonics

Topological semimetal and Fermi-arc surface states in the electronic structure of pyrochlore iridates

(2011) Xiangang Wan et al.   PHYSICAL REVIEW B

CO Oxidation Facilitated by Robust Surface States on Au-Covered Topological Insulators

(2011) Hua Chen et al.   PHYSICAL REVIEW LETTERS

Spin-orbit coupling and intersystem crossing in molecules

(2011) Christel M. Marian   Wiley Interdisciplinary Reviews-Computational Molecular Science

Alloys of platinum and early transition metals as oxygen reduction electrocatalysts

(2009) J. Greeley et al.   Nature Chemistry