Documentation for module qs_linres_polar_utils

Polarizability calculation by dfpt Initialization of the polar_env, Perturbation Hamiltonian by application of the Berry phase operator to psi0 Write output Deallocate everything periodic Raman SL February 2013

source: qs_linres_polar_utils.F
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public Subroutines/Functions:

Deallocate the polar environment
Initialize the polar environment
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Initialize the polar environment

SUBROUTINEpolar_env_cleanup(polar_env)

Deallocate the polar environment

Arguments:
:: polar_env ...

SUBROUTINEpolar_env_init(polar_env, qs_env)

Initialize the polar environment

Arguments:
:: polar_env ...
POINTER
:: qs_env ...

SUBROUTINEpolar_polar(polar_env, qs_env)

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Arguments:
:: polar_env ...
POINTER
:: qs_env ...

SUBROUTINEpolar_print(polar_env, qs_env)

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Arguments:
:: polar_env ...
POINTER
:: qs_env ...

SUBROUTINEpolar_response(polar_env, p_env, qs_env)

Initialize the polar environment

Arguments:
:: polar_env ...
POINTER
:: p_env ...
POINTER
:: qs_env ...