Vapor–liquid phase coexistence curves for Morse fluids JK Singh, J Adhikari, SK Kwak
Fluid phase equilibria 248 (1), 1-6, 2006
86 2006 Molecular simulation study of miscibility of ternary and quaternary InGaAlN alloys J Adhikari, DA Kofke
Journal of applied physics 95 (11), 6129-6137, 2004
51 2004 Molecular simulation study of miscibility in ternary alloys J Adhikari, DA Kofke
Journal of applied physics 95 (8), 4500-4502, 2004
40 2004 Thermodynamic modeling of phase equilibria of clathrate hydrates formed from CH4, CO2, C2H6, N2 and C3H8, with different equations of state DR Bhawangirkar, J Adhikari, JS Sangwai
The Journal of Chemical Thermodynamics 117, 180-192, 2018
37 2018 A review on property estimation methods and computational schemes for rational solvent design: a focus on pharmaceuticals M Harini, J Adhikari, KY Rani
Industrial & Engineering Chemistry Research 52 (21), 6869-6893, 2013
32 2013 Design of an ionic liquid as a solvent for the extraction of a pharmaceutical intermediate M Harini, S Jain, J Adhikari, SB Noronha, KY Rani
Separation and Purification Technology 155, 45-57, 2015
24 2015 Variational formula for the free energy based on incomplete sampling in a molecular simulation N Lu, J Adhikari, DA Kofke
Physical Review E 68 (2), 026122, 2003
20 2003 Monte Carlo and cell model calculations for the solid—fluid phase behaviour of the triangle-well model J Adhikari, DA Kofke
Molecular Physics 100 (10), 1543-1550, 2002
18 2002 Structural characterization of III–V zinc blende compound semiconductors using Monte Carlo simulations P Rathi, S Sikder, J Adhikari
Computational materials science 65, 122-126, 2012
14 2012 Prediction of thermodynamic properties of levulinic acid via molecular simulation techniques T Chakraborti, A Desouza, J Adhikari
ACS omega 3 (12), 18877-18884, 2018
9 2018 Prediction of fluid phase equilibria and interfacial tension of triangle-well fluids using transition matrix Monte Carlo A Sengupta, J Adhikari
Chemical Physics 469, 16-24, 2016
9 2016 Study of structural and thermodynamic properties of GaAs and InAs using Monte Carlo simulations J Adhikari, A Kumar
Molecular Simulation 33 (8), 623-628, 2007
9 2007 Computer‐Aided Solvent Selection and Design for the Efficient Extraction of a Pharmaceutical Molecule KN Shankar, J Adhikari, SB Noronha
The Canadian Journal of Chemical Engineering 97, 1605-1618, 2019
8 2019 Phase equilibria and critical point predictions of mixtures of molecular fluids using grand canonical transition matrix Monte Carlo T Chakraborti, J Adhikari
Industrial & Engineering Chemistry Research 56 (22), 6520-6534, 2017
8 2017 Prediction of Vapor–Liquid Coexistence Data for p -Cymene Using Equation of State Methods and Monte Carlo Simulations M Harini, J Adhikari, KY Rani
Journal of Chemical & Engineering Data 59 (10), 2987-2994, 2014
7 2014 Molecular simulation study of the structural properties in InxGa1− xAs alloys: Comparison between Valence Force Field and Tersoff potential models J Adhikari
Computational materials science 43 (4), 616-622, 2008
7 2008 Fluid phase equilibria of triangle-well fluids confined inside slit pores: A transition matrix Monte Carlo simulation study A Sengupta, J Adhikari
Journal of Molecular Liquids 221, 1184-1196, 2016
6 2016 Molecular simulation study of triangle-well fluids confined in slit pores A Sengupta, P Behera, J Adhikari
Molecular Physics 112 (15), 1969-1978, 2014
6 2014 Molecular simulation study of vapor-liquid equilibrium of morse fluids SK Kwak, JK Singh, J Adhikari
Chemical Product and Process Modeling 2 (3), 2007
6 2007 Interfacial properties of Morse fluids JK Singh, J Adhikari, SK Kwak
Molecular Physics 105 (8), 981-987, 2007
6 2007