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Molecular dynamics simulations of the O2−ion mobility in dense neon gas
- Source :
- 2017 IEEE 19th International Conference on Dielectric Liquids (ICDL).
- Publication Year :
- 2017
- Publisher :
- IEEE, 2017.
-
Abstract
- We report here the results of Molecular Dynamics simulations of the drift mobility of negative oxygen ions in very dense neon gas in the supercritical phase. The simulations relatively well reproduce the trend of the experimental data. The rationalization of the mobility behavior as a function of the gas density is given in terms of the number of atoms correlated in the first solvation shell around the ion.
- Subjects :
- Materials science
010401 analytical chemistry
chemistry.chemical_element
010402 general chemistry
01 natural sciences
Molecular physics
Supercritical fluid
0104 chemical sciences
Ion
Neon
Molecular dynamics
Solvation shell
chemistry
Phase (matter)
Physics::Atomic and Molecular Clusters
Oxygen ions
Subjects
Details
- Database :
- OpenAIRE
- Journal :
- 2017 IEEE 19th International Conference on Dielectric Liquids (ICDL)
- Accession number :
- edsair.doi...........1733d8937a8a0acc48e5600af5938473