[Wien] [Wien2k Users] ENE Warning
Ghosh SUDDHASATTWA
ssghosh at igcar.gov.in
Mon Dec 21 14:14:30 CET 2009
I have only changed Emax in case.in file and not in .in1 file. Is it ok?
-----Original Message-----
From: wien-bounces at zeus.theochem.tuwien.ac.at
[mailto:wien-bounces at zeus.theochem.tuwien.ac.at] On Behalf Of ??
Sent: Monday, December 21, 2009 1:30 PM
To: wien
Subject: Re: [Wien] [Wien2k Users] ENE Warning
Try to enlarge the "EMAX" in file case.in1 according to you system.
wangjingjing at ciac.jl.cn
2009-12-21
_______________________________________________
Wien mailing list
Wien at zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
More information about the Wien
mailing list