open source force-matching https://www.potfit.net/wiki/ Sat, 18 Apr 2026 10:48:24 +0000 FeedCreator 1.8 https://www.potfit.net/wiki/lib/exe/fetch.php?media=wiki:logo.png https://www.potfit.net/wiki/ https://www.potfit.net/wiki/doku.php?id=config:bocp&rev=1537693191 Box of Contributing Particles ---------- With this option it is possible to include only some atoms of a configuration in the optimization. This only affects forces; energies and stresses will ALWAYS be calculated for the entire configuration. anonymous@undisclosed.example.com (Anonymous) Sun, 23 Sep 2018 08:59:51 +0000 https://www.potfit.net/wiki/doku.php?id=config:main&rev=1537616150 Configurations ---------- The atomic configurations used for fitting are read from the configuration file which is specified in the parameter file. The format of the configuration is very simple and explained below. There is a command line tool to generate configuration files from anonymous@undisclosed.example.com (Anonymous) Sat, 22 Sep 2018 11:35:50 +0000