lattice.hpp File Reference

Crystal lattice functions. More...

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Namespaces
module	sirius
	Namespace of the SIRIUS library.

Functions
auto	sirius::metric_tensor (r3::matrix< double > const &lat_vec__)
	Compute a metric tensor. More...
double	sirius::metric_tensor_error (r3::matrix< double > const &lat_vec__, r3::matrix< int > const &R__)
	Compute error of the symmetry-transformed metric tensor. More...
auto	sirius::find_lat_sym (r3::matrix< double > const &lat_vec__, double tol__, double *mt_error__=nullptr)

Detailed Description

Crystal lattice functions.

Definition in file lattice.hpp.