Documentation for module manybody_quip

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source: manybody_quip.F
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public Subroutines/Functions:

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SUBROUTINEquip_add_force_virial(fist_nonbond_env, force, virial)

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Arguments:
POINTER
:: fist_nonbond_env ...
REAL(dp)
:: force(:,:) ...
REAL(dp)
:: virial(3,3) ...

SUBROUTINEquip_energy_store_force_virial(particle_set, cell, atomic_kind_set, potparm, fist_nonbond_env, pot_quip, para_env)

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Arguments:
POINTER
:: particle_set(:) ...
TYPE(cell_type),
POINTER
:: cell ...
POINTER
:: atomic_kind_set(:) ...
POINTER
:: potparm ...
POINTER
:: fist_nonbond_env ...
REAL(dp)
:: pot_quip ...
OPTIONAL, POINTER
:: para_env ...