Publications

Project Acronym: COMPIL
Title: Computer simulation of Polymeric/Ionic Liquid systems
Affiliation: national center for scientific research demokritos
Pi: Niki Vergadou
Research Field: chemical sciences and materials

Molecular Dynamics Simulation of the n-Octacosane–Water Mixture Confined in Graphene Mesopores: Comparison of Atomistic and Coarse-Grained Calculations and the Effect of Catalyst Nanoparticle
by Konstantinos D. Papavasileiou, Loukas D. Peristeras, Andreas Bick, Ioannis G. Economou
Reference:
Molecular Dynamics Simulation of the n-Octacosane–Water Mixture Confined in Graphene Mesopores: Comparison of Atomistic and Coarse-Grained Calculations and the Effect of Catalyst Nanoparticle (Konstantinos D. Papavasileiou, Loukas D. Peristeras, Andreas Bick, Ioannis G. Economou), In Energy & Fuels, volume 35, 2021.
Bibtex Entry:
@article{doi:10.1021-acs.energyfuels.0c04151,
 author = {Konstantinos D. Papavasileiou, Loukas D. Peristeras, Andreas Bick, Ioannis G. Economou},
 doi = {10.1021/acs.energyfuels.0c04151},
 url = {https://doi.org/10.1021/acs.energyfuels.0c04151},
 year = {2021},
 bibyear = {2021},
 journal = {Energy & Fuels},
 volume = {35},
 number = {5},
 pages = {4313–4332},
 title = {Molecular Dynamics Simulation of the n-Octacosane–Water Mixture Confined in Graphene Mesopores: Comparison of Atomistic and Coarse-Grained Calculations and the Effect of Catalyst Nanoparticle},
}