Molecular dynamics simulation and finite element analysis on mechanical behavior of oxygen functionalized graphene/polymer nanocomposites
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Mechanical Science and Technology"
DOI: 10.1007/s12206-018-1230-5
Abstract: The mechanical behavior of oxygen functionalized single layer graphene (graphene oxide, GO)/polyethylene (PE) nanocomposites is studied by all atom-based molecular dynamics (MD) simulation and finite element analysis (FEA). To account for the effect of the… read more here.
Keywords: oxygen functional; mechanical behavior; graphene; behavior oxygen ... See more keywords
The Effect of Oxygen Played in Nitrous Oxide Heterogeneous Reduction and the Behavior of Oxygen on Char Surface: Quantum Chemical and Kinetics Calculations
Sign Up to like & getrecommendations! Published in 2019 at "Combustion Science and Technology"
DOI: 10.1080/00102202.2019.1620737
Abstract: ABSTRACT Oxygen plays an important role in heterogeneous reduction of N2O by char in coal-fired power plants. In this study, we use quantum chemistry to investigate the most probable transition states, intermediates and products in… read more here.
Keywords: oxygen; reduction; behavior oxygen; char ... See more keywords