semi_empirical_mpole_types::nddo_mpole_type Type Reference

Global Multipolar NDDO information type. More...

Data Fields
real(kind=dp), dimension(:), pointer	charge
real(kind=dp), dimension(:), pointer	efield0
real(kind=dp), dimension(:, :), pointer	dipole
real(kind=dp), dimension(:, :), pointer	efield1
real(kind=dp), dimension(:, :), pointer	efield2
real(kind=dp), dimension(:, :, :), pointer	quadrupole

Detailed Description

Global Multipolar NDDO information type.

Author

Teodoro Laino [tlaino] - 08.2008 Zurich University

Definition at line 54 of file semi_empirical_mpole_types.F.

Field Documentation

charge

real(kind=dp), dimension(:), pointer semi_empirical_mpole_types::nddo_mpole_type::charge

Definition at line 55 of file semi_empirical_mpole_types.F.

efield0

real(kind=dp), dimension(:), pointer semi_empirical_mpole_types::nddo_mpole_type::efield0

Definition at line 55 of file semi_empirical_mpole_types.F.

dipole

real(kind=dp), dimension(:, :), pointer semi_empirical_mpole_types::nddo_mpole_type::dipole

Definition at line 56 of file semi_empirical_mpole_types.F.

efield1

real(kind=dp), dimension(:, :), pointer semi_empirical_mpole_types::nddo_mpole_type::efield1

Definition at line 56 of file semi_empirical_mpole_types.F.

efield2

real(kind=dp), dimension(:, :), pointer semi_empirical_mpole_types::nddo_mpole_type::efield2

Definition at line 56 of file semi_empirical_mpole_types.F.

quadrupole

real(kind=dp), dimension(:, :, :), pointer semi_empirical_mpole_types::nddo_mpole_type::quadrupole

Definition at line 57 of file semi_empirical_mpole_types.F.

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

• semi_empirical_mpole_types.F