Re: [Gausssum-help] cclib has problems parsing output file gaussian03
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From: Noel O'B. <bao...@gm...> - 2018-07-04 14:25:03
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Hi Otavio, Sorry to hear you are having problems. Can you send me directly a zipped version of a logfile. Note that I only fix bugs for public domain log files - are you happy to place the log file in the public domain? - Noel On 3 July 2018 at 01:43, Otávio Fuganti via Gausssum-help < gau...@li...> wrote: > Hi everybody, > > I'm have problem in open the gausssum (all versions). The program open but > when i'm try to open the output file the program open a window with a error. > > cclib has problems parsing > > > I am use in the input file the > iop(6/7=3,99/18=-1,99/10=512,3/33=1,3/36=-1) > Were the 3/33=1 and 3/36=-1 is for the gausssum > > > > > > ------- > > > Otávio Fuganti > Doutor em Química > Universidade Federal do Paraná > Setor de Ciências Exatas > Departamento de Química > Laboratório de Química Inorgânica Aplicada > P. Box 19032, 81531-980 Curitiba PR / Brasil > Celular: +55(41)9-9195-6737 > Comercial: +55(41)3361-3181 > Email: zox...@ya... > ota...@uf... > > ------- > > ------------------------------------------------------------ > ------------------ > Check out the vibrant tech community on one of the world's most > engaging tech sites, Slashdot.org! http://sdm.link/slashdot > _______________________________________________ > Gausssum-help mailing list > Gau...@li... > https://lists.sourceforge.net/lists/listinfo/gausssum-help > > |