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Generate the Second
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Determining
Vibrational Frequencies
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Calculate Dipole Moment
This will create a file17.dat from a file18.dat.
intder: (
derlvl = 1
trans_dipder = true
trans_type = i_to_c
freq_anal = none
)
CCQC WWW repository
Tue Aug 12 10:50:18 EDT 1997