topology_snapshot::snapshot_type Type Reference

Data Fields
integer	nao = 0
integer	rank = 0
integer	nspin = 0
integer	channel = 0
integer, dimension(3)	periodic = 0
real(kind=dp), dimension(3, 3)	cell = 0.0_dp
real(kind=dp), dimension(3, 3)	inverse = 0.0_dp
real(kind=dp), dimension(3)	k = 0.0_dp
type(snapshot_atom_type), dimension(:), allocatable	atoms
integer, dimension(:), allocatable	bands
real(kind=dp), dimension(:), allocatable	energies
complex(kind=dp), dimension(:, :), allocatable	coefficients

Detailed Description

Definition at line 35 of file topology_snapshot.F.

Field Documentation

nao

integer topology_snapshot::snapshot_type::nao = 0

Definition at line 36 of file topology_snapshot.F.

rank

integer topology_snapshot::snapshot_type::rank = 0

Definition at line 36 of file topology_snapshot.F.

nspin

integer topology_snapshot::snapshot_type::nspin = 0

Definition at line 36 of file topology_snapshot.F.

channel

integer topology_snapshot::snapshot_type::channel = 0

Definition at line 36 of file topology_snapshot.F.

periodic

integer, dimension(3) topology_snapshot::snapshot_type::periodic = 0

Definition at line 37 of file topology_snapshot.F.

cell

real(kind=dp), dimension(3, 3) topology_snapshot::snapshot_type::cell = 0.0_dp

Definition at line 38 of file topology_snapshot.F.

inverse

real(kind=dp), dimension(3, 3) topology_snapshot::snapshot_type::inverse = 0.0_dp

Definition at line 38 of file topology_snapshot.F.

k

real(kind=dp), dimension(3) topology_snapshot::snapshot_type::k = 0.0_dp

Definition at line 38 of file topology_snapshot.F.

atoms

type(snapshot_atom_type), dimension(:), allocatable topology_snapshot::snapshot_type::atoms

Definition at line 39 of file topology_snapshot.F.

bands

integer, dimension(:), allocatable topology_snapshot::snapshot_type::bands

Definition at line 40 of file topology_snapshot.F.

energies

real(kind=dp), dimension(:), allocatable topology_snapshot::snapshot_type::energies

Definition at line 41 of file topology_snapshot.F.

coefficients

complex(kind=dp), dimension(:, :), allocatable topology_snapshot::snapshot_type::coefficients

Definition at line 42 of file topology_snapshot.F.

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

• topology_snapshot.F