potfiles:main
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| potfiles:main [2018/09/23 09:31] – daniel | potfiles:main [2018/09/24 17:29] (current) – daniel | ||
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| Each potential file consists of a header and a body, just like the configurations. While the header format is the same for all supported potentials the body format is fundamentally different for tabulated, analytic and KIM potentials. | Each potential file consists of a header and a body, just like the configurations. While the header format is the same for all supported potentials the body format is fundamentally different for tabulated, analytic and KIM potentials. | ||
| - | For potentials implemented in //potfit// the number of potentials and parameters required for each interaction is given on the bottom of each interaction page. For KIM potentials please see the [[potfiles:format4|KIM format]] page for details. | + | For potentials implemented in //potfit// the number of potentials and parameters required for each interaction is given on the bottom of each interaction page. For KIM potentials please see the [[potfiles:format5|KIM format]] page for details. |
| ==== Potential File Header | ==== Potential File Header | ||
potfiles/main.1537687915.txt.gz · Last modified: 2018/09/23 09:31 by daniel