[Wien] need your help

sikander Azam sikander.physicst at gmail.com
Mon Oct 26 09:14:53 CET 2015


Dear
Yesterday the problem with the run -in1new 1 has been solved but now I am
facing this problem,

Error in LAPW2 'FERMI' - EFERMI OUT OF ENERGY RANGE 'FERMI' - STOP IN EFI
'FERMI' - ENERGY OF LOWER BOUND : -1.27904 'FERMI' - NUMBER OF STATES AT
THE LOWER BOUND : 0.00000 'FERMI' - ENERGY OF UPPER BOUND : 1.87113 'FERMI'
- NUMBER OF STATES AT THE UPPER BOUND : 18.00000 'FERMI' - ADD 18.00000
'FERMI' - SOS 0.0000.0000.0000.0000.0001.0000.0000.0000.0000.750 'FERMI' -
NOS **************************************************
please help me in this regard.
Regards
SIkander

On Sun, Oct 25, 2015 at 10:58 AM, sikander Azam <sikander.physicst at gmail.com
> wrote:

> Dear Sir Gavin Abo
> Thanks sir for your help.
> Regards
> Sikander
>
> On Sun, Oct 25, 2015 at 6:55 PM, Gavin Abo <gsabo at crimson.ua.edu> wrote:
>
>> Search the mailing list archive [
>> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/ ].
>>
>> When E-bottom and E-top are both -200, that typically indicates that
>> something is likely wrong with the struct file [
>> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg10860.html
>> ].
>>
>>
>> On 10/25/2015 11:34 AM, sikander Azam wrote:
>>
>> Dear All
>> Please help me in fixing the following error
>> ** Error in Parallel LAPW1 ** LAPW1 STOPPED at Sun Oct 25 18:30:40 CET
>> 2015 ** check ERROR FILES! Error in LAPW1 'SELECT' - no energy limits found
>> for atom 1 L= 0 'SELECT' - E-bottom -200.00000 E-top -200.00000 Error in
>> LAPW1 'SELECT' - no energy limits found for atom 1 L= 0 'SELECT' - E-bottom
>> -200.00000 E-top -200.00000 Error in LAPW1 'SELECT' - no energy limits
>> found for atom 1 L= 0 'SELECT' - E-bottom -200.00000 E-top -200.00000 Error
>> in LAPW1 'SELECT' - no energy limits found for atom 1 L= 0 'SELECT' -
>> E-bottom -200.00000 E-top -200.00000
>> Regards
>> SIkander
>>
>>
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>> SEARCH the MAILING-LIST at:
>> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>>
>>
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20151026/65919458/attachment.html>


More information about the Wien mailing list