| 11 |
Corrosion protection properties and interfacial adhesion mechanism of an epoxy/polyamide coating applied on the steel surface decorated with cerium oxide nanofilm: Complementary experimental, molecular dynamics (MD) and first principle quantum mechanics (QM) simulation methods
Bahlakeh G, Ramezanzadeh B, Saeb MR, Terryn H, Ghaffari M
Applied Surface Science, 419, 650, 2017 |
| 12 |
Molecular dynamics simulation of gas diffusion behavior in polyethylene terephthalate/aluminium/polyethylene interface
Wu H, Xin Y
Composite Interfaces, 24(9), 915, 2017 |
| 13 |
Identifying the significance of proton-electron transfer in CH4 production on Cu (100) in CO2 electro-reduction
Sheng T, Sun SG
Journal of Electroanalytical Chemistry, 793, 184, 2017 |
| 14 |
Sorption and Diffusion of CO2/N-2 in gas mixture in thermally-rearranged polymeric membranes: A molecular investigation
Rizzuto C, Caravella A, Brunetti A, Park CH, Lee YM, Drioli E, Barbieri G, Tocci E
Journal of Membrane Science, 528, 135, 2017 |
| 15 |
Separation of gases by using pristine, composite and nanocomposite polymeric membranes: A molecular dynamics simulation study
Golzar K, Modarress H, Amjad-Iranagh S
Journal of Membrane Science, 539, 238, 2017 |
| 16 |
Extraction of cadmium by TODGA-dodecane and TBP-dodecane: A comparative study by MD simulation
Singh MB, Mukhtyar AJ, Bootwala YZ, Gaikar VG
Separation Science and Technology, 52(7), 1172, 2017 |
| 17 |
Analysis of the relationship between lung cancer drug response level and atom connectivity dynamics based on trimmed Delaunay triangulation
Zou B, Wang DD, Ma LC, Chen LJ, Yan H
Chemical Physics Letters, 652, 117, 2016 |
| 18 |
Molecular dynamics simulation of physicochemical properties of the asphalt model
Yao H, Dai QL, You ZP
Fuel, 164, 83, 2016 |
| 19 |
Nanosecond-time-scale reversibility of dilation induced by carbon dioxide sorption in glassy polymer membranes
Neyertz S, Brown D
Journal of Membrane Science, 520, 385, 2016 |
| 20 |
Interfacial adhesion behavior of polyimides on silica glass: A molecular dynamics study
Min K, Kim Y, Goyal S, Lee SH, McKenzie M, Park H, Savoy ES, Rammohan AR, Mauro JC, Kim H, Chae K, Lee HS, Shin J, Cho E
Polymer, 98, 1, 2016 |
