화학공학소재연구정보센터
검색결과 : 787건
No. Article
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