Dear Dr. Maftei, I followed your advise ("create an empty file ... by issuing a command "touch TiC.struct") and surprisingly it did help. Thank you very much!
What is known about the "unknown reason"? Best regards. Igor Chaplygin On Wednesday 02 July 2008 11:30, Dan Maftei wrote: > Dear Dr. Chaplygin, > > For an unknown reason, in some cases w2web StructGen(TM) doesn't > generate a template structure as requested. I haven't notice that so far. > > As a workaround, you may create an empty file in your working directory > (namely TiC) by issuing a command "touch TiC.struct" (either in terminal > or in the w2web provided "command line"). You'll end up with an empty > structure which can be edited further using StructGen (use "edit STRUCT > file"). > > Regards, > Dan Maftei. > > Dr. Igor Chaplygin wrote: > > Dear Wien2k users, > > > > I am just starting using Wien2k and have immediately after installation > > of the program encountered a problem. Namely StructGen does not work. > > After execution of the corresponding w2web menu item a message: > > > > "StructGenTM > > You do not have a TiC.struct file yet. > > > > You can create it using STRUCTGEN. Please specify the number of > > independent atoms of your initial structure!" > > > > appears. After pressing "Generate template" nothing happens. No error > > message appears as well. I would appreciate any hint. > > > > Best regards > > Igor > > _______________________________________________ > > Wien mailing list > > Wien at zeus.theochem.tuwien.ac.at > > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien