vdw_lj_set Subroutine

public subroutine vdw_lj_set(specs)

Setter for LJ interaction. params(1) = eps, params(2) = sigma, params(3) = rcut cache(1) = sigma**2, cache(2) = U(rcut)

Arguments

Type IntentOptional Attributes Name
type(ia_specs_t), intent(inout) :: specs

Called by

proc~~vdw_lj_set~~CalledByGraph proc~vdw_lj_set vdw_lj_set proc~ia_vdw_setup ia_vdw_setup proc~ia_vdw_setup->proc~vdw_lj_set proc~ia_setup ia_setup proc~ia_setup->proc~ia_vdw_setup proc~setup setup proc~setup->proc~ia_setup program~main main program~main->proc~setup