occ_elastic_fit.h File Reference

#include <CLI/App.hpp>
#include <occ/crystal/crystal.h>
#include <occ/elastic_fit/monkhorst_pack.h>
#include <occ/elastic_fit/pes.h>
#include <occ/elastic_fit/potentials.h>

Include dependency graph for occ_elastic_fit.h:

Classes
struct	occ::main::EFSettings

Namespaces
namespace	occ
namespace	occ::main
	main module for functionaliity related to single point energies etc.

Functions
CLI::App *	occ::main::add_elastic_fit_subcommand (CLI::App &app)
void	occ::main::run_elastic_fit_subcommand (const EFSettings &settings)