models:analytic
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- | 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:: | The analytic potential implementation in //potfit// has additional features which are only useful with this kind of interactions. They are described on the [[potfiles:: |
models/analytic.1550911724.txt.gz · Last modified: 2019/02/23 09:48 by daniel