Documentation for module xc_tfw

Calculate the Thomas-Fermi kinetic energy functional plus the von Weizsaecker term

source: xc_tfw.F
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public Subroutines/Functions:

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SUBROUTINEtfw_lda_eval(rho_set, deriv_set, order)

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Arguments:
POINTER
:: rho_set ...
POINTER
:: deriv_set ...
INTEGER,
INTENT(in)
:: order ...

SUBROUTINEtfw_lda_info(reference, shortform, needs, max_deriv)

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Arguments:
CHARACTER(*),
INTENT(out),
OPTIONAL
:: reference ...
CHARACTER(*),
INTENT(out),
OPTIONAL
:: shortform ...
INTENT(inout),
OPTIONAL
:: needs ...
INTEGER,
INTENT(out),
OPTIONAL
:: max_deriv ...

SUBROUTINEtfw_lsd_eval(rho_set, deriv_set, order)

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Arguments:
POINTER
:: rho_set ...
POINTER
:: deriv_set ...
INTEGER,
INTENT(in)
:: order ...

SUBROUTINEtfw_lsd_info(reference, shortform, needs, max_deriv)

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Arguments:
CHARACTER(*),
INTENT(out),
OPTIONAL
:: reference ...
CHARACTER(*),
INTENT(out),
OPTIONAL
:: shortform ...
INTENT(inout),
OPTIONAL
:: needs ...
INTEGER,
INTENT(out),
OPTIONAL
:: max_deriv ...