| 1 |
Structural, rheological and dynamic aspects of hydrogen-bonding molecular liquids: Aqueous solutions of hydrotropic tert-butyl alcohol
Cerar J, Jamnik A, Pethes I, Temleitner L, Pusztai L, Tomsic M
Journal of Colloid and Interface Science, 560, 730, 2020 |
| 2 |
Hydration properties of alkali and alkaline earth metal ions in aqueous solution: A molecular dynamics study
Liu CF, Min FF, Liu LY, Chen J
Chemical Physics Letters, 727, 31, 2019 |
| 3 |
Graphene oxide and sulfonated-derivative: Proton transport properties and electrochemical behavior of Nafion-based nanocomposites
Simari C, Stallworth P, Peng J, Coppola L, Greenbaum S, Nicotera I
Electrochimica Acta, 297, 240, 2019 |
| 4 |
A study on thermodynamic and transport properties of carbon dioxide using molecular dynamics simulation
Chen L, Wang SY, Tao WQ
Energy, 179, 1094, 2019 |
| 5 |
Analysis of two common algorithms to compute self-diffusion coefficients in infinite dilution from molecular dynamics simulations and application to n-alkanes (C-1 to C-35) in water
Kirse C, Kindlein M, Luxenburger F, Elts E, Briesen H
Fluid Phase Equilibria, 485, 211, 2019 |
| 6 |
Transport properties of the Lennard-Jones truncated and shifted fluid from non-equilibrium molecular dynamics simulations
Lautenschlaeger MP, Hasse H
Fluid Phase Equilibria, 482, 38, 2019 |
| 7 |
Self-diffusion coefficient and viscosity of methane and carbon dioxide via molecular dynamics simulations based on new ab initio-derived force fields
Higgoda UA, Hellmann R, Koller TM, Froba AP
Fluid Phase Equilibria, 481, 15, 2019 |
| 8 |
Calculation of self-diffusion coefficient and surface tension of liquid alkali metals using square-well fluid
Nikoofard H, Kalantar Z, Rahmati N, Amin AH
Fluid Phase Equilibria, 487, 1, 2019 |
| 9 |
Enhancement of the predictive power of molecular dynamics simulations for the determination of self-diffusion coefficient and viscosity demonstrated for propane
Higgoda UA, Hellmann R, Koller TM, Froba AP
Fluid Phase Equilibria, 496, 69, 2019 |
| 10 |
The general form of transport diffusivity of shale gas in organic-rich nano-slits-A molecular simulation study using Darken approximation
Li YX, Hu ZM, Duan XG, Wang XY, Shi JL, Zhan HM
Fuel, 249, 457, 2019 |
