From: Adam T. <a-t...@st...> - 2007-09-03 16:22:14
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> There are two ADF failures: now is the time to decide whether we can > handle these. In the next version of cclib, we seriously need to > consider parsing the 'checkpoint' files or whatever they're called, > instead. This should be a lot less work. I sent a mail (titled ADF failures, August 28th) to the list about one of these failures. Basically there are two "problems" with the logfile. First, it has an incorrectly formatted create job. Second, it actually has two single point calculations in the file. Please look back at the email and reply with your comments. Adam |