Collisions between a ¹Δ Molecule and a Spherical Atom

BASISTYPE = 15

System subroutine: sydiat2p

Basis subroutine: hiba15_diat2p.F90

Ref. M.-L. Dubernet and J. M. Hutson, J. Chem. Phys. 101, 1939 (1994).

The definition of the integer system dependent parameters is as follows:

• NTERM (the number of potential surfaces involved: this should be 3 in this case). This parameter can not be changed

• IOP: ortho/para label for rotational states of diatomic. If IHOMO =.true. then
  • if IOP = 1: only para states included in channel expansion
  • if IOP = -1: only ortho states included in channel expansion
• JMAX: maximum rotational quantum number of diatomic.

The definition of the real system dependent parameters is as follows:

• BROT: rotational constantof diatomic molecule
• ASO: spin-orbit constant of ²P atom