tblite_integral_trafo Module Reference

Implemenation of transformations from cartesian to spherical harmonic basis functions. More...

Functions/Subroutines
pure subroutine, public	transform0 (lj, li, cart, sphr)
pure subroutine, public	transform1 (lj, li, cart, sphr)
pure subroutine, public	transform2 (lj, li, cart, sphr)

Detailed Description

Implemenation of transformations from cartesian to spherical harmonic basis functions.

Spherical harmonics use standard ordering, i.e. [-l, ..., 0, ..., l].