Temperature dependence of the microscopic structure and density anomaly of the SPC/E and TIP4P-Ew water models. Molecular dynamics simulation results
We have investigated temperature trends of the microscopic structure of the SPC/E and TIP4P-Ew water models in terms of the pair distribution functions, coordination numbers, the average number of hydrogen bonds, the distribution of bonding states of a single molecule as well as the angular distribu...
Gespeichert in:
| Veröffentlicht in: | Condensed Matter Physics |
|---|---|
| Datum: | 2015 |
| Hauptverfasser: | Galicia-Andrés, E., Dominguez, H., Pizio, O. |
| Format: | Artikel |
| Sprache: | English |
| Veröffentlicht: |
Інститут фізики конденсованих систем НАН України
2015
|
| Online Zugang: | https://nasplib.isofts.kiev.ua/handle/123456789/153513 |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|
| Назва журналу: | Digital Library of Periodicals of National Academy of Sciences of Ukraine |
| Zitieren: | Temperature dependence of the microscopic structure and density anomaly of the SPC/E and TIP4P-Ew water models. Molecular dynamics simulation results / E. Galicia-Andrés, H. Dominguez, O. Pizio // Condensed Matter Physics. — 2015. — Т. 18, № 1. — С. 13603:1-11. — Бібліогр.: 42 назв. — англ. |
Institution
Digital Library of Periodicals of National Academy of Sciences of UkraineÄhnliche Einträge
-
On the composition dependence of thermodynamic, dynamic and dielectric properties of water-methanol model mixtures. Molecular dynamics simulation results
von: Galicia-Andrés, E., et al.
Veröffentlicht: (2015) -
On the composition dependence of the microscopic structure, thermodynamic, dynamic and dielectric properties of water-dimethyl formamide model mixtures. Molecular dynamics simulation results
von: Dominguez, H., et al.
Veröffentlicht: (2017) -
Density anomaly of charged hard spheres of different diameters in a mixture with core-softened model solvent. Monte Carlo simulation results Author(s):
von: Hribar-Lee, B., et al.
Veröffentlicht: (2013) -
Molecular dynamics simulations of the properties of water-methanol mixtures. Effects of force fields
von: Cruz Sanchez, M, et al.
Veröffentlicht: (2019) -
Isobaric-isothermal molecular dynamics computer simulations of the properties of water-1,2-dimethoxyethane model mixtures
von: Gujt, J., et al.
Veröffentlicht: (2017)