Dr. Arya Das
Title
Cited by
Cited by
Year
Molecular dynamics simulation for the calibration of the OPLS force field using DFT derived partial charges for the screening of alkyl phosphate ligands by studying structure …
A Das, P Sahu, SM Ali
Journal of Chemical & Engineering Data 62 (8), 2280-2295, 2017
122017
Understanding of interfacial tension and interface thickness of liquid/liquid interface at a finite concentration of alkyl phosphate by molecular dynamics simulation
A Das, SM Ali
Journal of Molecular Liquids 277, 217-232, 2019
72019
Molecular Dynamics Simulation for the Test of Calibrated OPLS-AA Force Field for Binary Liquid Mixture of Tri-iso-amyl Phosphate and n-Dodecane
A Das, SM Ali
Journal of chemical Physics 148 (7), 2018
72018
Molecular dynamics simulation studies on structure, dynamics, and thermodynamics of uranyl nitrate solution at various acid concentrations
A Das, SM Ali
The Journal of Physical Chemistry B 123 (21), 4571-4586, 2019
52019
Unusual behavior of Stokes–Einstein relation in liquid mixtures
A Das, SM Ali
AIP Advances 10, 045327, 2020
22020
Deciphering the curved profile of uranyl ions at the aqueous-organic interface by atomistic simulations
A Das, SM Ali
Journal of Molecular Liquids 343, 117599, 2021
2021
Molecular dynamics simulation for the screening of composition of tri-isoamyl phosphate and dodecane for use in PUREX process
A Das, S Ali
Proceedings of the eight biennial symposium on emerging trends in separation …, 2018
2018
The system can't perform the operation now. Try again later.
Articles 1–7