[Wien] Error in Lapw1 using mBJ

[Masood Yousaf]

Thank you for your responce.

It happens at first iteration also When I choose the reduction to 5% then the file is executed successfully with the same parameters .
Kindly suggest me what to do ?

Ragards 

Masood




>________________________________
> From: "tran at theochem.tuwien.ac.at" <tran at theochem.tuwien.ac.at>
>To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> 
>Sent: Thursday, May 10, 2012 9:52 PM
>Subject: Re: [Wien] Error in Lapw1 using mBJ
> 
>When does it occur? Directly at the 1st iteration or later? 
>
>On Thu, 10 May 2012, Masood Yousaf wrote:
>
>> Dear Users
>> 
>> I am having problem in executing a file with mBJ. Fallowing error comes in Lapw1. Kindly guide me how to correct this error
>> 
>> Error in LAPW1
>>  'SELECT' - no energy limits found for L= 0                                    
>>  'SELECT' - E-bottom -200.00000   E-top -200.00000   
>> 
>> Thank you all
>> Masood
>> 
>_______________________________________________
>Wien mailing list
>Wien at zeus.theochem.tuwien.ac.at
>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
>
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120510/288c5cba/attachment.htm>