(git:3add494)
xc_adiabatic_methods.F File Reference

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Modules

module  xc_adiabatic_methods
 Contains some functions used in the context of adiabatic hybrid functionals.
 

Functions/Subroutines

subroutine, public xc_adiabatic_methods::rescale_mcy3_pade (qs_env, hf_energy, energy, adiabatic_lambda, adiabatic_omega, scale_dEx1, scale_ddW0, scale_dDFA, scale_dEx2, total_energy_xc)
 
  • Calculates rescaling factors for XC potentials and energy expression
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