pt_init Subroutine

public subroutine pt_init(mth, num_atoms, excl_atoms, rcut, tskn, bonds, simbox, pair_tab)

Performs initial setup for building a pair list.

Arguments

Type IntentOptional AttributesName
character(len=*), intent(in) :: mth
integer, intent(in) :: num_atoms
integer, intent(in) :: excl_atoms
real(kind=rp), intent(in) :: rcut
real(kind=rp), intent(in) :: tskn
integer, intent(in), dimension(:,:):: bonds
type(smbx_t), intent(in) :: simbox
type(itable_t), intent(inout) :: pair_tab

Calls

proc~~pt_init~~CallsGraph proc~pt_init pt_init proc~cl_init cl_init proc~pt_init->proc~cl_init proc~atat_build atat_build proc~pt_init->proc~atat_build proc~exat_build exat_build proc~pt_init->proc~exat_build proc~cl_set_cell_size cl_set_cell_size proc~pt_init->proc~cl_set_cell_size proc~itbl_init itbl_init proc~pt_init->proc~itbl_init proc~cl_build_cell_nbrs cl_build_cell_nbrs proc~pt_init->proc~cl_build_cell_nbrs interface~ivector_init ivector_init proc~cl_init->interface~ivector_init proc~atat_build->proc~itbl_init proc~atat_build->interface~ivector_init proc~exat_build->proc~itbl_init proc~exat_build->interface~ivector_init proc~itbl_init->interface~ivector_init interface~ivector_init->interface~ivector_init proc~ivector_from_array ivector_from_array interface~ivector_init->proc~ivector_from_array proc~ivector_from_array->interface~ivector_init

Called by

proc~~pt_init~~CalledByGraph proc~pt_init pt_init proc~ia_setup ia_setup proc~ia_setup->proc~pt_init proc~run run proc~run->proc~ia_setup program~main main program~main->proc~run

Contents

None