[Wien] the problem encountered in running init_lapw

Bing Zhou luxunca at yahoo.ca
Sat Aug 17 04:13:41 CEST 2013


Dear Gavin,
It seems the "x nn" problem is struct-specific, i.e., it works normally for other struct file, but not the attached one. Could you please give me further help?
Best wishes,
Bing
 

From: Gavin Abo <gsabo at crimson.ua.edu>
To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> 
Sent: Saturday, August 17, 2013 2:24:46 AM
Subject: Re: [Wien] the problem encountered in running init_lapw



Does it fix the problem if you start over, but do not use the brackets ([ and ]) in the directory and file names?

On 8/16/2013 8:35 AM, Bing Zhou wrote:

Dear all,
>When I run init_lapw with the attached struct file, it failed with the error message: "set: No match", could you please help me out?
>Thank you in advance!
>Bing Zhou

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