input_cp2k_xas.F File Reference

#include "./base/base_uses.f90"

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Modules
module	input_cp2k_xas
	function that build the XAS section of the input

Functions/Subroutines
subroutine, public	input_cp2k_xas::create_xas_section (section)
	makes the input section for core-level spectroscopy simulations
subroutine, public	input_cp2k_xas::create_xas_tdp_section (section)
	makes the input section for core-level spectroscopy simulations using linear response TDDFT