Embedded Files
2025
Verma, Ashutosh Kumar; Thorat, Amey; Chauhan, Rohit; Sartape, Rohan; Singh, Meenesh; Shah, Jindal
Identifying High Ionic Conductivity Compositions of Ionic Liquid Electrolytes Using Features of the Solvation Environment Journal Article
In: Journal of Chemical Theory Computation, 21, 4, pp. 1929–1940, 2025.
Verma, Ashutosh Kumar; Thorat, Amey; Shah, Jindal
In: The Journal of Physical Chemistry B, 129, 9, pp. 2546–2559, 2025.
2024
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Influence of Pore Geometry on Wetting Behavior in 2D Nanomaterials for Desalination and Advanced Nanofluidics Journal Article
In: ACS Applied Nanomaterials, 8, 1, pp. 904–914, 2025.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Interfacial properties of 2D materials-based membrane: A combined first-principles and classical simulations study Journal Article
In: Computational Materials Science, 246, pp. 113457, 2025.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
The Impact of Pore Geometry on Frictional Properties of hBN and MoS2 Nanomaterials Journal Article
In: The Journal of Physical Chemistry B, 128, 47, pp. 11814–11824, 2024.
Thorat, Amey; Verma, Ashutosh Kumar; Shah, Jindal
Influence of Solution Environment on Estimation of Ionic Conductivity in Ionic Liquid Electrolytes Journal Article
In: AIChE Annual Meeting, 636e, 2024.
Verma, Ashutosh Kumar; Thorat, Amey; Shah, Jindal
Effect of Polarization on Ionic Conductivity Predictions in Binary Ionic Liquid Mixtures Journal Article
In: AIChE Annual Meeting, 203g, 2024.
Verma, Ashutosh Kumar; Thorat, Amey; Shah, Jindal
Force Field Development for Pyrrolidinium-Based Ionic Liquids for Ionic Conductivity Predictions Journal Article
In: AIChE Annual Meeting, 169an, 2024.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
A molecular insight into frictional properties of hexagonal boron nitride: Exploring surface roughness and force field impact Journal Article
In: Computational Materials Science, 245, pp. 113323, 2024.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Impact of Atomic Defects on Water Contact Angle of 2D Molybdenum Disulfide Surfaces Journal Article
In: Langmuir, 40, 38, pp. 20120–20132, 2024.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Unveiling the impact of atomic-scale defects and surface roughness on interfacial properties in hexagonal boron nitride Journal Article
In: Surfaces and Interfaces, 51, pp. 104646, 2024.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Modulating the Water Contact Angle Using Surface Roughness: Interfacial Properties of Hexagonal Boron Nitride Surfaces Journal Article
In: Langmuir, 40, 31, pp. 16058–16068, 2024.
Verma, Ashutosh Kumar; Sharma, Bharat Bhushan
Experimental and Theoretical Insights into Interfacial Properties of 2D Materials for Selective Water Transport Membranes: A Critical Review Journal Article
In: Langmuir, 40, 15, pp. 7812–7834, 2024.
Verma, Ashutosh Kumar; Thorat, Amey S., Shah, Jindal K.
Estimating Ionic Conductivity of Ionic Liquids: Nernst-Einstein and Einstein Formalisms Journal Article
In: Journal of Ionic Liquid, 100089, 2024.
2023
Verma, Ashutosh Kumar; Thorat, Amey K., Shah, Jindal K.
Ionic Conductivity of Imidazolium-Based Ionic Liquids: Nernst-Einstein and Einstein Formalism Journal Article
In: AIChE Annual Meeting, 555c, 2023.
Verma, Ashutosh Kumar; Govind Rajan, Ananth
Wetting and Frictional Properties of Hexagonal Boron Nitride with Atomic-Scale Defects and Roughness Journal Article
In: Indian Institute of Science, 2023.
2022
Verma, Ashutosh Kumar; Govind Rajan, Ananth
Surface Roughness Explains the Observed Water Contact Angle and Slip Length on 2D Hexagonal Boron Nitride Journal Article
In: Langmuir, vol. 38, no. 30, pp. 9210–9220, 2022.
Verma, Ashutosh Kumar; Kumar, P.
In: Journal of Nanotechnology, 1–9, 2022.
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