qmmm_types_low::qmmm_per_pot_type Type Reference

Periodic Potential. More...

Data Fields
real(kind=dp), dimension(:), pointer	lg
real(kind=dp), dimension(:), pointer	gx
real(kind=dp), dimension(:), pointer	gy
real(kind=dp), dimension(:), pointer	gz
real(kind=dp)	gmax
real(kind=dp), dimension(3)	fac
integer, dimension(3)	kmax
integer, dimension(3)	n_rep_real
integer, dimension(:), pointer	mm_atom_index
type(pw_pool_type), pointer	pw_pool
type(pw_grid_type), pointer	pw_grid
type(pw_r3d_rs_type), pointer	tablr

Detailed Description

Periodic Potential.

Definition at line 90 of file qmmm_types_low.F.

Field Documentation

lg

real(kind=dp), dimension(:), pointer qmmm_types_low::qmmm_per_pot_type::lg

Definition at line 91 of file qmmm_types_low.F.

gx

real(kind=dp), dimension(:), pointer qmmm_types_low::qmmm_per_pot_type::gx

Definition at line 91 of file qmmm_types_low.F.

gy

real(kind=dp), dimension(:), pointer qmmm_types_low::qmmm_per_pot_type::gy

Definition at line 91 of file qmmm_types_low.F.

gz

real(kind=dp), dimension(:), pointer qmmm_types_low::qmmm_per_pot_type::gz

Definition at line 91 of file qmmm_types_low.F.

gmax

real(kind=dp) qmmm_types_low::qmmm_per_pot_type::gmax

Definition at line 92 of file qmmm_types_low.F.

fac

real(kind=dp), dimension(3) qmmm_types_low::qmmm_per_pot_type::fac

Definition at line 92 of file qmmm_types_low.F.

kmax

integer, dimension(3) qmmm_types_low::qmmm_per_pot_type::kmax

Definition at line 93 of file qmmm_types_low.F.

n_rep_real

integer, dimension(3) qmmm_types_low::qmmm_per_pot_type::n_rep_real

Definition at line 93 of file qmmm_types_low.F.

mm_atom_index

integer, dimension(:), pointer qmmm_types_low::qmmm_per_pot_type::mm_atom_index

Definition at line 94 of file qmmm_types_low.F.

pw_pool

type(pw_pool_type), pointer qmmm_types_low::qmmm_per_pot_type::pw_pool

Definition at line 95 of file qmmm_types_low.F.

pw_grid

type(pw_grid_type), pointer qmmm_types_low::qmmm_per_pot_type::pw_grid

Definition at line 96 of file qmmm_types_low.F.

tablr

type(pw_r3d_rs_type), pointer qmmm_types_low::qmmm_per_pot_type::tablr

Definition at line 97 of file qmmm_types_low.F.

---

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

• qmmm_types_low.F