Documentation for module qs_rho_atom_methods

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source: qs_rho_atom_methods.F
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public Subroutines/Functions:

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SUBROUTINEallocate_rho_atom_internals(qs_env, rho_atom_set)

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Arguments:
POINTER
:: qs_env ...
POINTER
:: rho_atom_set(:) ...

SUBROUTINEcalculate_rho_atom(para_env, rho_atom_set, qs_kind, atom_list, grid_atom, natom, nspins, tot_rho1_h, tot_rho1_s)

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Arguments:
POINTER
:: para_env ...
POINTER
:: rho_atom_set(:) ...
INTENT(in)
:: qs_kind ...
INTEGER,
INTENT(in)
:: atom_list(:) ...
INTENT(in)
:: grid_atom ...
INTEGER,
INTENT(in)
:: natom ...
INTEGER,
INTENT(in)
:: nspins ...
REAL(dp),
INTENT(inout)
:: tot_rho1_h(:) ...
REAL(dp),
INTENT(inout)
:: tot_rho1_s(:) ...

SUBROUTINEcalculate_rho_atom_coeff(qs_env, rho_ao, rho_atom_set)

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Arguments:
POINTER
:: qs_env ...
POINTER
:: rho_ao(:,:) ...
OPTIONAL, POINTER
:: rho_atom_set(:) ...

SUBROUTINEinit_rho_atom(qs_env, gapw_control)

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Arguments:
POINTER
:: qs_env ...
POINTER
:: gapw_control ...