[Gausssum-help] cclib has problems parsing output file gaussian03
Brought to you by:
baoilleach
From: Otávio F. <zox...@ya...> - 2018-07-03 01:13:33
|
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 theiop(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 FugantiDoutor em QuímicaUniversidade Federal do ParanáSetor de Ciências ExatasDepartamento de QuímicaLaboratório de Química Inorgânica AplicadaP. Box 19032, 81531-980 Curitiba PR / BrasilCelular: +55(41)9-9195-6737Comercial: +55(41)3361-3181Email: zox...@ya... ota...@uf... ------- |