화학공학소재연구정보센터
검색결과 : 84건
No. Article
1 Bridging two-liquid theory with molecular simulations for electrolytes: An investigation of aqueous NaCl solution
Saravi SH, Ravichandran A, Khare R, Chen CC
AIChE Journal, 65(4), 1315, 2019
2 A theoretical study on the adsorption of acid gases by boron nitride-based nanomaterials
Rozas S, Alcalde R, Atilhan M, Aparicio S
Applied Surface Science, 480, 83, 2019
3 Unlocking CO2 separation performance of ionic liquid/CuBTC composites: Combining experiments with molecular simulations
Polat HM, Zeeshan M, Uzun A, Keskin S
Chemical Engineering Journal, 373, 1179, 2019
4 Effects of ionic hydration and hydrogen bonding on flow resistance of ionic aqueous solutions confined in molybdenum disulfide nanoslits: Insights from molecular dynamics simulations
Zhang YM, Zhu W, Li JH, Zhu YD, Wang AR, Lu XH, Li W, Shi YJ
Fluid Phase Equilibria, 489, 23, 2019
5 Kirkwood-Buff integrals from molecular simulation
Dawass N, Kruger P, Schnell SK, Simon JM, Vlugt TJH
Fluid Phase Equilibria, 486, 21, 2019
6 Ono-Kondo lattice model for propane multilayer adsorption in organic nanopores in relation to shale gas
Pang WY, Jin ZH
Fuel, 235, 158, 2019
7 Spatial distribution of reservoir fluids in mature kerogen using molecular simulations
Perez F, Devegowda D
Fuel, 235, 448, 2019
8 Porous organic cages embedded in a lipid membrane for water desalination: A molecular simulation study
Zhao DH, Liu J, Jiang JW
Journal of Membrane Science, 573, 177, 2019
9 Multi-chain slip-spring simulations for polyisoprene melts
Masubuchi Y, Uneyama T
Korea-Australia Rheology Journal, 31(4), 241, 2019
10 Influence of solvation on the structure of highly charged nanoparticles in salt-free solutions
Chremos A, Douglas JF
Polymer, 170, 107, 2019