All files created by the Hibridon package are given lower case names with the first character in upper case.

All files written during a calculation, except the main output file, are designated {jobname}n.ext, where n denotes the energy at which the calculation has been carried out (n = 1 for first energy, n = 2 for second energy, etc.) and the file extension ext can be

• ics for integral cross sections (created if the flag WRXSEC is set .true. and a necessary prerequisite to the command PRINTC)

• xsc for selected integral cross sections (created by the command PRINTC)

• smt for S matrix elements (created if the flag WRSMAT is set .true. or by the command OPTIMIZE; a necessary prerequisite to the commands PRINTS and DIFCRS)

• dcs for differential cross sections (created by the command DIFCRS) pcs for partial cross sections (created if the flag WRPART is set .true.)

• psc for partial cross sections as output of the command PARTC)

• tcb for a table of tensor cross sections (as output of the command TENXSC and necessary prerequisite for the command MRCRS)

• tcs for tensor cross sections (as output of the command TENXSC)

• mcs for a table of m-resolved integral cross sections (as output of the command MRCRS)

• wfu for wavefunction transformation matrices (created if the flag WAVEFL is set .true. and a necessary prerequisite to the commands FLUX, EADIAB, and PSI)

• psi for scattering wavefunctions (created by the command PSI)

• flx for fluxes or adiabatic energies (as output of the commands FLUX and EADIAB)

The jobname is set by the variable

JOB={jobname},

where {jobname} is a character string (not in quotes). The default value of {jobname} is Job

❗ Both {jobname} and the file extensions are converted internally to lower case with the first character of {jobname} in upper case.

❗ All of the above files are formatted, except the .smt, .tcb, and .wfu files which are unformatted (binary).