Hi, Gavin, Thanks for you reply. It helps a lot. Yundi
On Mon, Jan 14, 2013 at 5:55 PM, Yundi Quan <quanyundi at gmail.com> wrote: > Hi, > I used the following input file for lapw7. But I got an error message > saying 'ERROR: UNKNOWN UNITS OPTION'. In the userguide, units can be ANG, > AU or ATU. I tried all of them. But none of them worked. Can anyone offer > me any suggestions? > > 3D RTHO > 0 0 0 2 > 3 0 0 3 > 0 3 0 3 > 0 0 3 3 > 141 141 141 25 25 25 > NO > RE ANG LARGE > 1 0 > -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20130115/0bad7c4a/attachment.htm>
