SIRIUS 7.5.0
Electronic structure library and applications
potential Directory Reference

Files

file  check_xc_potential.cpp [code]
 Check XC potential by doing numerical functional derivative.
 
file  generate_d_operator_matrix.cpp [code]
 
file  generate_pw_coeffs.cpp [code]
 
file  paw_potential.cpp [code]
 
file  poisson.cpp [code]
 
file  potential.cpp [code]
 Generate effective potential.
 
file  potential.hpp [code]
 Contains declaration and partial implementation of sirius::Potential class.
 
file  xc.cpp [code]
 Generate XC potential.
 
file  xc_functional.hpp [code]
 Contains implementation of sirius::XC_functional class.
 
file  xc_functional_base.hpp [code]
 
file  xc_mt.cpp [code]
 Generate XC potential in the muffin-tins.