[Wien] min error

[WANG Yuan Xu]

Dear all，

when i optimized a surface structure by PORT method, after two structure change step, lapw1 error happen and show "Lapw1 crashed". The case.in2, I set FOR.
The attached file is outputM files.
How to deal with it? 
Thank you!	

Best


WANG Yuan Xu
wang.yuanxu at nims.go.jp
2004-07-14

Message: 21
Subject: RE: [Wien] how to calculate the ion-doped semiconductor
Date: Fri, 9 Jul 2004 09:44:47 +0200
From: "Jorissen Kevin" <Kevin.Jorissen at ua.ac.be>
To: <wien at zeus.theochem.tuwien.ac.at>
Reply-To: wien at zeus.theochem.tuwien.ac.at

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