-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 On Tuesday 10 August 2004 04:19, Valentin Gogonea wrote: > I am trying to visualize the vibrational frequencies for a molecule for > which I ran a compound job opt+freq with gaussian98. I get an error > when I try to read in the file. I tried to 're-arrange' the file > basically cutting out the optimization part, but it doesn't work. Is > there a solution except for running another frequency calculation?
It might be possible that there is a bug in the gaussian98 reader... can we see the file, private, or if possible, redistributable? In the former case, send to file in a private email to Miguel or me... Egon - -- [EMAIL PROTECTED] PhD on Molecular Representation in Chemometrics Nijmegen University http://www.cac.sci.kun.nl/people/egonw/ GPG: 1024D/D6336BA6 "Again a chemist did something useful with a computer" -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.0.7 (SunOS) iD8DBQFBGFyFd9R8I9Yza6YRAq7/AJ42aidL4BxMfiQHFewKMoUPLcCmdACeIy8g XrDbdoFNnGJ7sfwyyYBty4g= =hyee -----END PGP SIGNATURE----- ------------------------------------------------------- SF.Net email is sponsored by Shop4tech.com-Lowest price on Blank Media 100pk Sonic DVD-R 4x for only $29 -100pk Sonic DVD+R for only $33 Save 50% off Retail on Ink & Toner - Free Shipping and Free Gift. http://www.shop4tech.com/z/Inkjet_Cartridges/9_108_r285 _______________________________________________ Jmol-users mailing list [EMAIL PROTECTED] https://lists.sourceforge.net/lists/listinfo/jmol-users
