Related references
Note: Only part of the references are listed.Machine learning assisted high-throughput screening of transition metal single atom based superb hydrogen evolution electrocatalysts
Muhammad Umer et al.
JOURNAL OF MATERIALS CHEMISTRY A (2022)
Late Transition Metal Doped MXenes Showing Superb Bifunctional Electrocatalytic Activities for Water Splitting via Distinctive Mechanistic Pathways
Rohit Anand et al.
ADVANCED ENERGY MATERIALS (2021)
Tuning metal single atoms embedded in NxCy moieties toward high-performance electrocatalysis
Miran Ha et al.
ENERGY & ENVIRONMENTAL SCIENCE (2021)
Uncovering the electrochemical mechanisms for hydrogen evolution reaction of heteroatom doped M2C MXene (M = Ti, Mo)
Bo Ding et al.
APPLIED SURFACE SCIENCE (2020)
Application and comparison of several machine learning algorithms and their integration models in regression problems
Jui-Chan Huang et al.
NEURAL COMPUTING & APPLICATIONS (2020)
Identification of Efficient Single-Atom Catalysts Based on V2CO2 MXene by ab Initio Simulations
Xinwei Yang et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2020)
3d transitional-metal single atom catalysis toward hydrogen evolution reaction on MXenes supports
Zihan Shen et al.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY (2020)
High-Throughput Screening of Hydrogen Evolution Reaction Catalysts in MXene Materials
Jingnan Zheng et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2020)
Interface Chemistry on MXene-Based Materials for Enhanced Energy Storage and Conversion Performance
Xiaobin Hui et al.
ADVANCED FUNCTIONAL MATERIALS (2020)
Descriptors for Hydrogen Evolution on Single Atom Catalysts in Nitrogen-Doped Graphene
Victor Fung et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2020)
Machine-learning-accelerated screening of hydrogen evolution catalysts in MBenes materials
Xiang Sun et al.
APPLIED SURFACE SCIENCE (2020)
Covalent surface modifications and superconductivity of two-dimensional metal carbide MXenes
Vladislav Kamysbayev et al.
SCIENCE (2020)
Chemical Leaching of Inactive Cr and Subsequent Electrochemical Resurfacing of Catalytically Active Sites in Stainless Steel for High-Rate Alkaline Hydrogen Evolution Reaction
Sengeni Anantharaj et al.
ACS APPLIED ENERGY MATERIALS (2020)
Single-atom Ru anchored in nitrogen-doped MXene (Ti3C2Tx) as an efficient catalyst for the hydrogen evolution reaction at all pH values
Haigang Liu et al.
JOURNAL OF MATERIALS CHEMISTRY A (2020)
Accelerating 2D MXene catalyst discovery for the hydrogen evolution reaction by computer-driven workflow and an ensemble learning strategy
Xiaoxu Wang et al.
JOURNAL OF MATERIALS CHEMISTRY A (2020)
First-principles based machine learning study of oxygen evolution reactions of perovskite oxides using a surface center-environment feature model
Xiaomeng Wang et al.
APPLIED SURFACE SCIENCE (2020)
A machine learning scheme for the catalytic activity of alloys with intrinsic descriptors
Ze Yang et al.
JOURNAL OF MATERIALS CHEMISTRY A (2020)
Multi-heteroatom-doped carbon from waste-yeast biomass for sustained water splitting
Jitendra N. Tiwari et al.
NATURE SUSTAINABILITY (2020)
Machine learning-based high throughput screening for nitrogen fixation on boron-doped single atom catalysts
Mohammad Zafari et al.
JOURNAL OF MATERIALS CHEMISTRY A (2020)
Surface Termination Dependent Work Function and Electronic Properties of Ti3C2Tx MXene
Thorsten Schultz et al.
CHEMISTRY OF MATERIALS (2019)
Single Atoms and Clusters Based Nanomaterials for Hydrogen Evolution, Oxygen Evolution Reactions, and Full Water Splitting
Siraj Sultan et al.
ADVANCED ENERGY MATERIALS (2019)
Precious-Metal-Free Electrocatalysts for Activation of Hydrogen Evolution with Nonmetallic Electron Donor: Chemical Composition Controllable Phosphorous Doped Vanadium Carbide MXene
Yeoheung Yoon et al.
ADVANCED FUNCTIONAL MATERIALS (2019)
Recent advances and applications of machine learning in solid-state materials science
Jonathan Schmidt et al.
NPJ COMPUTATIONAL MATERIALS (2019)
Heteroatom-Mediated Interactions between Ruthenium Single Atoms and an MXene Support for Efficient Hydrogen Evolution
Vinoth Ramalingam et al.
ADVANCED MATERIALS (2019)
Pt-Based electrocatalysts with high atom utilization efficiency: from nanostructures to single atoms
Lei Zhang et al.
ENERGY & ENVIRONMENTAL SCIENCE (2019)
A theoretical study of electrocatalytic ammonia synthesis on single metal atom/MXene
Yijing Gao et al.
CHINESE JOURNAL OF CATALYSIS (2019)
Identification of single-atom active sites in carbon-based cobalt catalysts during electrocatalytic hydrogen evolution
Linlin Cao et al.
NATURE CATALYSIS (2019)
Cu single atoms on Ti2CO2 as a highly efficient oxygen reduction catalyst in a proton exchange membrane fuel cell
Qiong Peng et al.
JOURNAL OF MATERIALS CHEMISTRY A (2019)
Machine learning for heterogeneous catalyst design and discovery
Bryan R. Goldsmith et al.
AICHE JOURNAL (2018)
High-throughput theoretical optimization of the hydrogen evolution reaction on MXenes by transition metal modification
Pengkun Li et al.
JOURNAL OF MATERIALS CHEMISTRY A (2018)
Superior structural, elastic and electronic properties of 2D titanium nitride MXenes over carbide MXenes: a comprehensive first principles study
Ning Zhang et al.
2D MATERIALS (2018)
MBene (MnB): a new type of 2D metallic ferromagnet with high Curie temperature
Zhou Jiang et al.
NANOSCALE HORIZONS (2018)
Multicomponent electrocatalyst with ultralow Pt loading and high hydrogen evolution activity
Jitendra N. Tiwari et al.
NATURE ENERGY (2018)
Single platinum atoms immobilized on an MXene as an efficient catalyst for the hydrogen evolution reaction
Jinqiang Zhang et al.
NATURE CATALYSIS (2018)
Active learning across intermetallics to guide discovery of electrocatalysts for CO2 reduction and H2 evolution
Kevin Tran et al.
NATURE CATALYSIS (2018)
Carbon dioxide adsorption of two-dimensional carbide MXenes
Bingxin Wang et al.
JOURNAL OF ADVANCED CERAMICS (2018)
Interaction trends between single metal atoms and oxide supports identified with density functional theory and statistical learning
Nolan J. O'Connor et al.
NATURE CATALYSIS (2018)
Single-Atom Catalysts of Precious Metals for Electrochemical Reactions
Jiwhan Kim et al.
CHEMSUSCHEM (2018)
2D MXenes: A New Family of Promising Catalysts for the Hydrogen Evolution Reaction
Guoping Gao et al.
ACS CATALYSIS (2017)
Advanced capabilities for materials modelling with QUANTUM ESPRESSO
P. Giannozzi et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2017)
A comparative overview of hydrogen production processes
Pavlos Nikolaidis et al.
RENEWABLE & SUSTAINABLE ENERGY REVIEWS (2017)
High-throughput screening of bimetallic catalysts enabled by machine learning
Zheng Li et al.
JOURNAL OF MATERIALS CHEMISTRY A (2017)
Fault and Error Tolerance in Neural Networks: A Review
Cesar Torres-Huitzil et al.
IEEE ACCESS (2017)
Feature engineering of machine-learning chemisorption models for catalyst design
Zheng Li et al.
CATALYSIS TODAY (2017)
Searching for Highly Active Catalysts for Hydrogen Evolution Reaction Based on O-Terminated MXenes through a Simple Descriptor
Chongyi Ling et al.
CHEMISTRY OF MATERIALS (2016)
Hydrogen production from renewable and sustainable energy resources: Promising green energy carrier for clean development
Seyed Ehsan Hosseini et al.
RENEWABLE & SUSTAINABLE ENERGY REVIEWS (2016)
A general-purpose machine learning framework for predicting properties of inorganic materials
Logan Ward et al.
NPJ COMPUTATIONAL MATERIALS (2016)
Dependence of elastic and optical properties on surface terminated groups in two-dimensional MXene monolayers: a first-principles study
Yuelei Bai et al.
RSC ADVANCES (2016)
Hydrogen from photo-catalytic water splitting process: A review
H. Ahmad et al.
RENEWABLE & SUSTAINABLE ENERGY REVIEWS (2015)
25th Anniversary Article: MXenes: A New Family of Two-Dimensional Materials
Michael Naguib et al.
ADVANCED MATERIALS (2014)
Pseudopotentials for high-throughput DFT calculations
Kevin F. Garrity et al.
COMPUTATIONAL MATERIALS SCIENCE (2014)
Highly active and durable non-precious-metal catalysts encapsulated in carbon nanotubes for hydrogen evolution reaction
Jiao Deng et al.
ENERGY & ENVIRONMENTAL SCIENCE (2014)
Two-Dimensional Transition Metal Carbides
Michael Naguib et al.
ACS NANO (2012)
QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
Paolo Giannozzi et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2009)
Energy, environment and sustainable development
Abdeen Mustafa Omer
RENEWABLE & SUSTAINABLE ENERGY REVIEWS (2008)
Calculated phase diagrams for the electrochemical oxidation and reduction of water over Pt(111)
Jan Rossmeisl et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Trends in the exchange current for hydrogen evolution
JK Norskov et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2005)
Share Paper
