atprop_types::atprop_type Type Reference

type for the atomic properties More...

Data Fields
logical	energy = .FALSE.
logical	stress = .FALSE.
real(kind=dp), dimension(:), pointer	atener => NULL()
real(kind=dp), dimension(:), pointer	ateb => NULL()
real(kind=dp), dimension(:), pointer	atexc => NULL()
real(kind=dp), dimension(:), pointer	ateself => NULL()
real(kind=dp), dimension(:), pointer	atevdw => NULL()
real(kind=dp), dimension(:), pointer	ategcp => NULL()
real(kind=dp), dimension(:), pointer	atecc => NULL()
real(kind=dp), dimension(:), pointer	ate1c => NULL()
real(kind=dp), dimension(:), pointer	atecoul => NULL()
real(kind=dp), dimension(:, :, :), pointer	atstress => NULL()

Detailed Description

type for the atomic properties

Author

fawzi

Definition at line 31 of file atprop_types.F.

Field Documentation

energy

logical atprop_types::atprop_type::energy = .FALSE.

Definition at line 32 of file atprop_types.F.

stress

logical atprop_types::atprop_type::stress = .FALSE.

Definition at line 33 of file atprop_types.F.

atener

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::atener => NULL()

Definition at line 34 of file atprop_types.F.

ateb

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::ateb => NULL()

Definition at line 35 of file atprop_types.F.

atexc

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::atexc => NULL()

Definition at line 36 of file atprop_types.F.

ateself

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::ateself => NULL()

Definition at line 37 of file atprop_types.F.

atevdw

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::atevdw => NULL()

Definition at line 38 of file atprop_types.F.

ategcp

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::ategcp => NULL()

Definition at line 39 of file atprop_types.F.

atecc

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::atecc => NULL()

Definition at line 40 of file atprop_types.F.

ate1c

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::ate1c => NULL()

Definition at line 41 of file atprop_types.F.

atecoul

real(kind=dp), dimension(:), pointer atprop_types::atprop_type::atecoul => NULL()

Definition at line 42 of file atprop_types.F.

atstress

real(kind=dp), dimension(:, :, :), pointer atprop_types::atprop_type::atstress => NULL()

Definition at line 43 of file atprop_types.F.

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The documentation for this type was generated from the following file:

• subsys/atprop_types.F