Raj wrote: > I'm interested in using the output of a gamess frequency job to > animate vibrational modes. I'm using gamess (Sep 6, 2001, R5.x) and I > got a .dat file as well as output to the screen. When I try and load the > .dat file into Jmol (v10) I get an unrecognized file format error.
Jmol v10 does not yet support gamess format. -- 2 minutes later -- I just took a look at the v9 gamess reader. The format looks quite simple. I suspect that Egon or I can get to it within a week. Please send me two gamess output files that I can add to Jmol CVS. One small file and one larger file. Send them to me off-list to [EMAIL PROTECTED] If Egon does it then he probably will not need any help. If I do it then I may need to ask questions about the meanings of the entries in the output. Miguel ------------------------------------------------------- This SF.Net email is sponsored by BEA Weblogic Workshop FREE Java Enterprise J2EE developer tools! Get your free copy of BEA WebLogic Workshop 8.1 today. http://ads.osdn.com/?ad_id=5047&alloc_id=10808&op=click _______________________________________________ Jmol-users mailing list [EMAIL PROTECTED] https://lists.sourceforge.net/lists/listinfo/jmol-users
