[Wien] regarding hanging of job and mBJ

[Dr. K. C. Bhamu]

Please find enclosed brj.f file.

Sincerely
------------------------------------------------
Dr. K. C. Bhamu
(UGC-Dr. D. S. Kothari Postdoc Fellow)
Department of Physics
Goa University, Goa-403 206
India
Mob. No.  +91-9975238952

On Tue, Oct 25, 2016 at 5:04 PM, <tran at theochem.tuwien.ac.at> wrote:

> In this case I don't understand why lapw0 is hanging. Can you
> send the subroutine brj.f?
>
> On Tuesday 2016-10-25 12:18, Dr. K. C. Bhamu wrote:
>
> Date: Tue, 25 Oct 2016 12:18:41
>> From: Dr. K. C. Bhamu <kcbhamu85 at gmail.com>
>> Reply-To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.
>> at>
>> To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
>> Subject: Re: [Wien] regarding hanging of job and mBJ
>>
>>
>>      Probably your are using an old version of WIEN2k with the old
>>      scheme
>>      to find the solution of the nonlinear equation in brj.f. You
>>      should get
>>      the new version brj.f which avoids such problems.
>>
>>
>> No, I am using latest version of Wien2k with mkl+ifort.
>> It is not for all case. It happens for few cases and it doesn't matter
>> that
>> which case I am running.
>>
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>>
>>
>>
>>
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