The command PRINTC allows you to print out a subset of previously calculated integral cross sections (in units of square Angstroms) which have been written to file {jobname}n.ics. The subset of integral cross sections which will be printed corresponds to all transitions out of levels for which the rotational quantum number is specified in the array JOUT and for which the additional quantum index is specified in the array INDOUT. The command line syntax is

PRINTC,{jobname},iprint,iaver,ienerg

where

• {jobnam}: the jobname under which the integral cross sections have been stored as {jobname}n.ics. Here n denotes the value of the parameter ienerg (see below). Integral cross section (.ics) files can be generated by setting the flag WRXSEC = .true. The default value of {jobnam} is the value of the jobname you have set with the instruction

  JOB ={jobname}
  

❗ Note that for full close-coupling determinations of integral cross sections it is necessary to carry out calculations for both values of this parity (this is ensured by setting JLPAR=0; see the JLPAR frame for more information)

If no value of {jobnam}has been set, the default value of {jobname} is Job

• iprint:

  • iprint < 0 if the subset of desired integral cross sections is to be printed to the file {jobname}n.xsc
  • iprint .ge. 0, if the subset of desired integral cross sections is also to be printed to the main output file
  • iprint > 0, if the list of channel energies is also to be printed to the main output file.

The default value of iprint is 0

• iaver:

  • iaver = 0 if the full matrix of integral cross sections is to be printed.

  • iaver = 1 if the integral cross sections are to be summed over positive and negative values of the additional quantum index of the final state

  • iaver = 2 if the integral cross sections are to be summed and averaged over positive and negative values of the additional quantum index of the initial and final states

❗this summing and averaging is sure to work only if there is an even number of open levels with alternating values (positive and negative) of the quantum index The default value of iaver is 0

• ienerg: The cardinal value of the energy for which the integral cross sections are to be computed. i.e. if ienerg = 2, then the second energy S matrix file {jobname}2.smt or second energy integral cross section file {jobname}2.ics are used. The default value of inerg is 1