Hi guys, I have a problem to calculate the TDDFt of benzoic acid. I ran the same processess to benzene and piridine but fot the benzoic acid the calculate don't converged.
Please, take a look in my input and output.
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[ benzoic-acid-tddft.inp ]
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Fri Dec 6 '13 0:14am![[ Reply ]](/ceilidh-icons/ceil_rep.gif){kind=icon}
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