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Yashasvi S. Ranawat
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DScribe: Library of descriptors for machine learning in materials science
L Himanen, MOJ Jäger, EV Morooka, FF Canova, YS Ranawat, DZ Gao, ...
Computer Physics Communications 247, 106949, 2020
5822020
Efficient machine-learning-aided screening of hydrogen adsorption on bimetallic nanoclusters
MOJ Jager, YS Ranawat, FF Canova, EV Morooka, AS Foster
ACS combinatorial science 22 (12), 768-781, 2020
182020
Borophene layers on an Al (111) surface–the finding of a borophene layer with hexagonal double chains and B 9 nonagons using ab initio calculations
J Karthikeyan, YS Ranawat, P Murugan, V Kumar
Nanoscale 10 (36), 17198-17205, 2018
112018
Predicting hydration layers on surfaces using deep learning
YS Ranawat, YM Jaques, AS Foster
Nanoscale Advances 3 (12), 3447-3453, 2021
82021
Differences in Molecular Adsorption Emanating from the (2× 1) Reconstruction of Calcite (104)
J Heggemann, YS Ranawat, O Krejci, AS Foster, P Rahe
The Journal of Physical Chemistry Letters 14 (7), 1983-1989, 2023
52023
Parameterization of interatomic potential by genetic algorithms: A case study
PS Ghosh, YS Ranawat, A Arya, GK Dey
AIP Conference Proceedings 1665 (1), 2015
32015
Generalised deep-learning workflow for the prediction of hydration layers over surfaces
YS Ranawat, YM Jaques, AS Foster
Journal of Molecular Liquids 367, 120571, 2022
22022
Effect of shear strain on band structure and electronic properties of phosphorene
YS Ranawat, R Jain
arXiv preprint arXiv:1512.05392, 2015
12015
Water adsorption lifts the (2× 1) reconstruction of calcite (104)
J Heggemann, S Aeschlimann, T Dickbreder, YS Ranawat, R Bechstein, ...
Physical Chemistry Chemical Physics, 2024
2024
Simulating molecular adsorption on dielectric surfaces with classical MD, DFT and machine learning
YS Ranawat
Aalto University, 2023
2023
DScribe
L Himanen, MOJ Jäger, EV Morooka, F Federici Canova, YS Ranawat, ...
Elsevier Science BV, 2020
2020
Descriptor based adsorption-energy prediction on nano-clusters for catalyst selection
Y Ranawat
2018
Phase Field Modeling of Microstructure Evolution During Phase Transformations in Materials
YS Ranawat, GS Kanth
2013
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Articles 1–13