potfit wiki

open source force-matching

User Tools

Site Tools


potentials:main

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision
Previous revision
potentials:main [2018/01/10 17:41] – ↷ Links adapted because of a move operation danielpotentials:main [2020/09/28 17:23] (current) daniel
Line 1: Line 1:
 ~~NOTOC~~ ~~NOTOC~~
 ====== Potentials generated with potfit ====== ====== Potentials generated with potfit ======
 +-----
 This page contains a non-conclusive list of potentials created with //potfit//. This page contains a non-conclusive list of potentials created with //potfit//.
  
 A detailed description and the potentials in //potfit//-format are available on the pages listed below: A detailed description and the potentials in //potfit//-format are available on the pages listed below:
  
------+==== Ba-Ge / Ba-Si ==== 
 +ADP potentials for dynamic properties of [[potentials:bage|Ba-Ge]] and [[potentials:basi|Ba-Si]] clathrate systems
  
 ====  Al-Pd-Mn ==== ====  Al-Pd-Mn ====
-EAM potential for the $\xi$ phases of [[:potentials_alpdmn|Al-Pd-Mn]]+EAM potential for the $\xi$ phases of [[potentials:alpdmn|Al-Pd-Mn]]
  
 ====  Al-Ni-Co  ==== ====  Al-Ni-Co  ====
-Potentials for basic Ni-rich [[:potentials_alnico|d-AlNiCo]] quasicrystal and approximants+Potentials for basic Ni-rich [[potentials:alnico|d-AlNiCo]] quasicrystal and approximants
  
 ====  Al$_2$-O$_3$  ==== ====  Al$_2$-O$_3$  ====
 Pair potential with electrostatic contributions (both coulombic and dipolar)  Pair potential with electrostatic contributions (both coulombic and dipolar) 
-for crystalline $\alpha$-alumina ([[:potentials_alo|Al$_2$O$_3$]])+for crystalline $\alpha$-alumina ([[potentials:alo|Al$_2$O$_3$]])
  
 ====  Ca-Cd  ==== ====  Ca-Cd  ====
-Potential to model low-temperature structures of the [[:potentials_cacd|CaCd$_{5.6}$]] quasicrystal +Potential to model low-temperature structures of the [[potentials:cacd|CaCd$_{5.6}$]] quasicrystal 
 and related approximants. and related approximants.
  
 ====  Mg-O  ==== ====  Mg-O  ====
 Pair potential with electrostatic contributions (both coulombic and dipolar) for  Pair potential with electrostatic contributions (both coulombic and dipolar) for 
-liquid magnesia ([[:potentials_mgo|MgO]])+liquid magnesia ([[potentials:mgo|MgO]])
  
 ====  Mg-Zn  ==== ====  Mg-Zn  ====
-Potential to simulate vibrational properties of the [[:potentials_mgzn|MgZn$_2$]] Laves phase and +Potential to simulate vibrational properties of the [[potentials:mgzn|MgZn$_2$]] Laves phase and 
 related phases at ambient temperature. related phases at ambient temperature.
  
 ====  Si-O$_2$  ==== ====  Si-O$_2$  ====
 Pair potential with electrostatic contributions (both coulombic and dipolar) for liquid  Pair potential with electrostatic contributions (both coulombic and dipolar) for liquid 
-silica ([[:potentials_sio|SiO$_2$]])+silica ([[potentials:sio|SiO$_2$]])
  
potentials/main.1515602506.txt.gz · Last modified: 2018/01/10 17:41 by daniel