| Slip-spring model for the linear and nonlinear viscoelastic properties of molten polyethylene derived from atomistic simulations AP Sgouros, G Megariotis, DN Theodorou Macromolecules 50 (11), 4524-4541, 2017 | 67 | 2017 |
| Molecular dynamics simulations of EPON-862/DETDA epoxy networks: structure, topology, elastic constants, and local dynamics SV Kallivokas, AP Sgouros, DN Theodorou Soft matter 15 (4), 721-733, 2019 | 62 | 2019 |
| Molecular simulations of free and graphite capped polyethylene films: estimation of the interfacial free energies AP Sgouros, GG Vogiatzis, G Kritikos, A Boziki, A Nikolakopoulou, ... Macromolecules 50 (21), 8827-8844, 2017 | 56 | 2017 |
| Compressive response and buckling of graphene nanoribbons AP Sgouros, G Kalosakas, K Papagelis, C Galiotis Scientific reports 8 (1), 9593, 2018 | 34 | 2018 |
| Slip spring-based mesoscopic simulations of polymer networks: Methodology and the corresponding computational code G Megariotis, GG Vogiatzis, AP Sgouros, DN Theodorou Polymers 10 (10), 1156, 2018 | 33 | 2018 |
| Molecular dynamics study of polyethylene under extreme confinement G Kritikos, A Sgouros, GG Vogiatzis, DN Theodorou Journal of Physics: Conference Series 738 (1), 012012, 2016 | 33 | 2016 |
| Multiscale simulations of graphite-capped polyethylene melts: brownian dynamics/kinetic Monte Carlo compared to atomistic calculations and experiment AP Sgouros, GG Vogiatzis, G Megariotis, C Tzoumanekas, DN Theodorou Macromolecules 52 (19), 7503-7523, 2019 | 27 | 2019 |
| Mesoscopic simulations of free surfaces of molten polyethylene: Brownian dynamics/kinetic Monte Carlo coupled with square gradient theory and compared to atomistic calculations … AP Sgouros, AT Lakkas, G Megariotis, DN Theodorou Macromolecules 51 (23), 9798-9815, 2018 | 24 | 2018 |
| Uniaxial compression of suspended single and multilayer graphenes AP Sgouros, G Kalosakas, C Galiotis, K Papagelis 2D Materials 3 (2), 025033, 2016 | 23 | 2016 |
| Phononic band gap engineering in graphene A Sgouros, MM Sigalas, G Kalosakas, K Papagelis, NI Papanicolaou Journal of Applied Physics 112 (9), 2012 | 22 | 2012 |
| Efficient mechanical stress transfer in multilayer graphene with a ladder-like architecture AP Sgouros, C Androulidakis, G Tsoukleri, G Kalosakas, N Delikoukos, ... ACS Applied Materials & Interfaces 13 (3), 4473-4484, 2021 | 19 | 2021 |
| Self-consistent field theory coupled with square gradient theory of free surfaces of molten polymers and compared to atomistic simulations and experiment AT Lakkas, AP Sgouros, DN Theodorou Macromolecules 52 (14), 5337-5356, 2019 | 19 | 2019 |
| Multiscale simulations of polyzwitterions in aqueous bulk solutions and brush array configurations AP Sgouros, S Knippenberg, M Guillaume, DN Theodorou Soft Matter 17 (48), 10873-10890, 2021 | 16 | 2021 |
| Exotic carbon nanostructures obtained through controllable defect engineering AP Sgouros, G Kalosakas, MM Sigalas, K Papagelis RSC Advances 5 (50), 39930-39937, 2015 | 16 | 2015 |
| Transforming graphene nanoribbons into nanotubes by use of point defects A Sgouros, MM Sigalas, K Papagelis, G Kalosakas Journal of Physics: Condensed Matter 26 (12), 125301, 2014 | 16 | 2014 |
| Structure and thermodynamics of grafted silica/polystyrene dilute nanocomposites investigated through self-consistent field theory AT Lakkas, AP Sgouros, CJ Revelas, DN Theodorou Soft Matter 17 (15), 4077-4097, 2021 | 14 | 2021 |
| Nanoscale phononic interconnects in THz frequencies AP Sgouros, MR Neupane, MM Sigalas, N Aravantinos-Zafiris, RK Lake Physical Chemistry Chemical Physics 16 (42), 23355-23364, 2014 | 14 | 2014 |
| Potential of mean force between bare or grafted silica/polystyrene surfaces from self-consistent field theory AP Sgouros, CJ Revelas, AT Lakkas, DN Theodorou Polymers 13 (8), 1197, 2021 | 13 | 2021 |
| Atomistic simulations of long-chain polyethylene melts flowing past gold surfaces: Structure and wall-slip AP Sgouros, DN Theodorou Molecular Physics 118 (9-10), e1706775, 2020 | 13 | 2020 |
| Ab initio study of boron and aluminum hydrides nanoparticles FI Michos, AP Sgouros, MM Sigalas International Journal of Hydrogen Energy 41 (44), 20210-20216, 2016 | 12 | 2016 |
Doros TheodorouProfessor of Chemical Engineering, National Technical University of AthensVerified email at central.ntua.gr
