Elements

n_types -- integer

Number of atomic types

atomic_num -- integer, allocatable, dimension(:)

Atomic number dimensioned as n_types

type_of_atomic_num -- integer, allocatable, dimension(:)

Atomic number dimensioned as n_types

cutoff -- real(dp)

R1 -- real(dp), allocatable, dimension(:,:)

IP parameters

R2 -- real(dp), allocatable, dimension(:,:)

IP parameters

De -- real(dp), allocatable, dimension(:,:)

IP parameters

S -- real(dp), allocatable, dimension(:,:)

IP parameters

beta -- real(dp), allocatable, dimension(:,:)

IP parameters

delta -- real(dp), allocatable, dimension(:,:)

IP parameters

Re -- real(dp), allocatable, dimension(:,:)

IP parameters

a0 -- real(dp), allocatable, dimension(:,:,:)

IP parameters

c0 -- real(dp), allocatable, dimension(:,:,:)

IP parameters

d0 -- real(dp), allocatable, dimension(:,:,:)

IP parameters

shift -- real(dp), allocatable, dimension(:,:)

label -- character(len=FIELD_LENGTH)

mpi -- type(mpi_context)

Initialise interface