potfit wiki

open source force-matching

User Tools

Site Tools


models:analytic

Differences

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

Link to this comparison view

Both sides previous revisionPrevious revision
models:analytic [2019/02/23 09:48] danielmodels:analytic [2019/02/23 09:52] (current) daniel
Line 10: Line 10:
 {{ :analytic.png?300 }} {{ :analytic.png?300 }}
  
-Using an analytic form for $V(r)$ allows to define the atomic interaction for all possible distances between atoms with very few parameters compared to tabulated potentials. The problem of local parameters (see [[#Tabulated potentials]]) is also not present, parameters are usually global parameters. In certain cases it is even possible to attribute some physical meaning to individual parameters.+Using an analytic form for $V(r)$ allows to define the atomic interaction for all possible distances between atoms with very few parameters compared to tabulated potentials. The problem of local parameters (see [[tabulated|Tabulated potentials]]) is also not present, parameters are usually global parameters. In certain cases it is even possible to attribute some physical meaning to individual parameters.
  
 The analytic potential implementation in //potfit// has additional features which are only useful with this kind of interactions. They are described on the [[potfiles::format0|analytic format]] page. The analytic potential implementation in //potfit// has additional features which are only useful with this kind of interactions. They are described on the [[potfiles::format0|analytic format]] page.
models/analytic.1550911724.txt.gz · Last modified: 2019/02/23 09:48 by daniel