Water models: Difference between revisions
Jump to navigation
Jump to search
(Added MB-pol potential) |
Carl McBride (talk | contribs) m (Added an internal linlk) |
||
| Line 72: | Line 72: | ||
*[[NSPCE]] | *[[NSPCE]] | ||
*[[NvdE]] | *[[NvdE]] | ||
*[[OPC3 model of water | OPC3]] | |||
==P== | ==P== | ||
Revision as of 11:04, 16 September 2016
The following is an incomplete list of models used in computer simulations of water:
A
B
C
D
E
F
G
H
K
M
N
P
Q
R
S
Simple Point Charge models
- SPC
- SPC/ε
- SPC/A
- SPC/E
- SPC/F
- SPC/F2
- SPC/FP
- SPC/FQ
- SPC/Fw
- SPC/HW
- SPC/L
- SPCP
- SPC-pol
- SSD
- ST2
- ST2RF
- SWFLEX
- SWM4-DP
- SWM4-NDP
- SWM6
T
Transferable Intermolecular Potential models
- TIP3P
- TIP3P/Fs
- TIP4F
- TIP4P
- TIP4P/2005
- TIP4P/2005f
- TIP4P/ε
- TIP4P-Ew
- TIP4P/FQ
- TIP4P-HB
- TIP4P-I
- TIP4P/Ice
- TIP4P-pol
- TIP4PQ/2005
- TIP4PQ_D2O
- TIP4PQ_T2O
- TIP4P-QDP
- TIP4P-QDP-LJ
- TIP4Q
- TIP5P
- TIP5P-E
- TIPS
- TIPS2
- TTM2-F
- TTM2-R
- TTM2.1
- TTM2.1-F
- TTM3-F
V
W
Recommended reading
- Bertrand Guillot "A reappraisal of what we have learnt during three decades of computer simulations on water", Journal of Molecular Liquids, 101 pp. 219-260 (2002)
- Carlos Vega and Jose L. F. Abascal "Simulating water with rigid non-polarizable models: a general perspective", Phys. Chem. Chem. Phys. 13 pp. 19663-19688 (2011)
- Water Models, from Martin Chaplin's Water Structure and Science