Publications

Project Acronym: MD_DeTAC
Title: Molecular Dynamics Simulation Study of the Formation of Cationic surfactant Micelles in water: The Case of the Structural and Dynamical Properties of N,N,N-Decyltrimethylammonium Chloride in Water and Acetone
Affiliation: national and kapodistrian university of athens
Pi: Jannis Samios
Research Field: chemical sciences and materials

A study of the micellar aggregation of aqueous N, N, N-decyltrimethyl ammonium chloride via extended microsecond-time atomistic molecular dynamics simulation and realistic potential models
by Kainourgiakis, Emmanouil and Samios, Jannis
Reference:
A study of the micellar aggregation of aqueous N, N, N-decyltrimethyl ammonium chloride via extended microsecond-time atomistic molecular dynamics simulation and realistic potential models (Kainourgiakis, Emmanouil and Samios, Jannis), In Journal of Molecular Liquids, Elsevier, volume 331, 2021.
Bibtex Entry:
@article{doi:10.1016-j.molliq.2021.115644,
 title = {A study of the micellar aggregation of aqueous N, N, N-decyltrimethyl ammonium chloride via extended microsecond-time atomistic molecular dynamics simulation and realistic potential models},
 author = {Kainourgiakis, Emmanouil and Samios, Jannis},
 journal = {Journal of Molecular Liquids},
 volume = {331},
 pages = {115644},
 year = {2021},
 bibyear = {2021},
 publisher = {Elsevier},
 url = {https://www.sciencedirect.com/science/article/abs/pii/S016773222100369X?via%3Dihub},
 doi = {10.1016/j.molliq.2021.115644},
}