Mohnish Pandey

Universität Ulm — Germany

Materials Science · Physical Sciences

19h-index2.7kcitations37works0.02yr avg
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Research Topics

2D Materials and Applications(14), Perovskite Materials and Applications(10), Chalcogenide Semiconductor Thin Films(8), MXene and MAX Phase Materials(8), Quantum Dots Synthesis And Properties(6)

Publications37 total

Influence of Local Inhomogeneities and the Electrochemical Environment on the Oxygen Reduction Reaction on Pt-Based Electrodes: A DFT Study
The Journal of Physical Chemistry C·2020· 16 cited
From materials discovery to solar cells: LaYS 3 as a product of the computation/experiment loop
Bulletin of the American Physical Society·2020
Reply to comment on ‘The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals’
2D Materials·2019· 15 citedOpen Access
Shining Light on Sulfide Perovskites: LaYS<sub>3</sub> Material Properties and Solar Cells
Chemistry of Materials·2019· 43 citedOpen Access
Role of Long-Range Dispersion Forces in Modeling of MXenes as Battery Electrode Materials
The Journal of Physical Chemistry C·2019· 9 cited
Promising quaternary chalcogenides as high-band-gap semiconductors for tandem photoelectrochemical water splitting devices: A computational screening approach
Physical Review Materials·2018· 35 citedOpen Access
Efficient Charge Separation in 2D Janus van der Waals Structures with Built-in Electric Fields and Intrinsic p–n Doping
The Journal of Physical Chemistry C·2018· 105 cited
Efficient Charge Separation in 2D Janus van der Waals Structures with\n Build-in Electric Fields and Intrinsic p-n Doping
arXiv (Cornell University)·2018Open Access
Efficient Charge Separation in 2D Janus van der Waals Structures with Build-in Electric Fields and Intrinsic p-n Doping
arXiv (Cornell University)·2018Open Access
Definition of a scoring parameter to identify low-dimensional materials components
DSpace@MIT (Massachusetts Institute of Technology)·2018Open Access
The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals
2D Materials·2018· 1.1k citedOpen Access
High-Throughput Computational Assessment of Previously Synthesized Semiconductors for Photovoltaic and Photoelectrochemical Devices
ACS Energy Letters·2018· 67 cited
Fundamental limitation of electrocatalytic methane conversion to methanol
Physical Chemistry Chemical Physics·2018· 99 cited
Chapter 3. Computational Screening of Light-absorbing Materials for Photoelectrochemical Water Splitting
RSC energy and environment series·2018· 2 cited
Efficient Charge Separation in 2D Janus van der Waals Structures with Built-in Electric Fields and Intrinsic p-n Doping
Technical University of Denmark, DTU Orbit (Technical University of Denmark, DTU)·2018Open Access
II–IV–V<sub><b>2</b></sub> and III–III–V<sub><b>2</b></sub> Polytypes as Light Absorbers for Single Junction and Tandem Photovoltaic Devices
The Journal of Physical Chemistry C·2017· 21 cited
Two-Dimensional MXenes as Catalysts for Electrochemical Hydrogen Evolution: A Computational Screening Study
The Journal of Physical Chemistry C·2017· 247 cited
Band structure engineered layered metals for low-loss plasmonics
Nature Communications·2017· 83 citedOpen Access
Sulfide perovskites for solar energy conversion applications: computational screening and synthesis of the selected compound LaYS<sub>3</sub>
Energy & Environmental Science·2017· 140 citedOpen Access
Sustainable solar fuels and electricity through discovery and prototyping of new materials
Technical University of Denmark, DTU Orbit (Technical University of Denmark, DTU)·2017Open Access
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Frequent Co-authors

Kristian S. Thygesen(21), Karsten W. Jacobsen(20), Anders C. Riis-Jensen(6), Brian Seger(6), Korina Kuhar(6), Ivano E. Castelli(4), Peter C. K. Vesborg(4), Ib Chorkendorff(4), Raj Ganesh S. Pala(4), Mikkel Strange(3), Per S. Schmidt(3), Morten N. Gjerding(3), Peter Mahler Larsen(3), Thomas Olsen(3), Andrea Crovetto(3), Ole Hansen(3), Sten Haastrup(2), Thorsten Deilmann(2), Nicki F. Hinsche(2), Daniele Torelli(2)