[HTML][HTML] Unlocking the potential: machine learning applications in electrocatalyst design for electrochemical hydrogen energy transformation

R Ding, J Chen, Y Chen, J Liu, Y Bando… - Chemical Society …, 2024 - pubs.rsc.org
Machine learning (ML) is rapidly emerging as a pivotal tool in the hydrogen energy industry
for the creation and optimization of electrocatalysts, which enhance key electrochemical …

Advancements in MXene-based frameworks towards photocatalytic hydrogen production, carbon dioxide reduction and pollutant degradation: Current challenges and …

Z Ajmal, A Hayat, A Qadeer, Y Zhao, EH Ibrahim… - Coordination Chemistry …, 2025 - Elsevier
Abstract The 2D-MXene frameworks (2D-MXene) comprising transition metal carbide,
nitride, is regarded next generation advanced material, that have procured significant …

MXenes and heterostructures-based electrocatalysts for hydrogen evolution reaction: Recent developments and future outlook

A Hanan, HTA Awan, F Bibi, RRR Sulaiman… - Journal of Energy …, 2024 - Elsevier
The increasing focus on electrocatalysis for sustainable hydrogen (H 2) production has
prompted significant interest in MXenes, a class of two-dimensional (2D) materials …

[HTML][HTML] Electrochemical Properties of MXenes and Applications.

MP Bilibana - Advanced Sensor and Energy Materials, 2023 - Elsevier
MXenes, a two-dimensional transition metal carbide, nitride, and carbonitride family, have
received a lot of interest in recent years due to their unique properties and diverse …

Catalysis in the digital age: Unlocking the power of data with machine learning

BM Abraham, MV Jyothirmai, P Sinha… - Wiley …, 2024 - Wiley Online Library
The design and discovery of new and improved catalysts are driving forces for accelerating
scientific and technological innovations in the fields of energy conversion, environmental …

Accelerating the Discovery of gC3N4-Supported Single Atom Catalysts for Hydrogen Evolution Reaction: A Combined DFT and Machine Learning Strategy

MV Jyothirmai, D Roshini, BM Abraham… - ACS Applied Energy …, 2023 - ACS Publications
Two-dimensional materials supported by single atom catalysis (SAC) is foreseen to replace
platinum for large-scale industrial scalability of sustainable hydrogen generation. Here, a …

[HTML][HTML] A review on catalyst convergence: Unleashing the potential of MXenes for CO2 electrochemical reduction into high-value liquid product

MH Jameel, M Arain, I Hussain, MB Hanif, S Atri… - Nano Materials …, 2024 - Elsevier
The electrochemical reduction reaction of carbon dioxide (CO 2-ERR) holds tremendous
potential as a key approach for achieving carbon neutrality by harnessing renewable …

InVO4-Decorated Ti3C2 MXene for Efficient Photocatalytic Hydrogen Evolution

SJ Kalita, S Varangane, P Basyach… - … Applied Materials & …, 2024 - ACS Publications
The generation of hydrogen through photocatalysis is a fascinating technology for
addressing environmental concerns and the energy crisis. Nevertheless, the quest for cost …

Machine learning driven advancements in catalysis for predicting hydrogen evolution reaction activity

P Sinha, MV Jyothirmai, BM Abraham… - Materials Chemistry and …, 2024 - Elsevier
In the field of catalysis research, the emergence of machine learning (ML) has triggered a
significant transformation, revolutionizing our methodologies for exploring and …

[HTML][HTML] Theoretical modelling of the hydrogen evolution reaction on MXenes: A critical review

L Meng, F Vines, F Illas - Current Opinion in Electrochemistry, 2023 - Elsevier
Abstract MXenes, two-dimensional (2D) transition-metal carbides and nitrides with diverse
compositions and structures, have attracted notable attention due to their potential as …