[Wien] running calculation

[lokanath patra]

Thank you for your suggestions.

On Mon, Jul 13, 2015 at 2:12 PM, Gavin Abo <gsabo at crimson.ua.edu> wrote:

> You might also want to search and read about .stop (to safely stop an scf
> cycle before a time limit or scheduled interruption like a power outage)
> and -s PROGRAM (to start from a previously good program step if killed by a
> time limit or unscheduled interruption) in the WIEN2k usersguide.
>
>
> On 7/13/2015 1:19 AM, Peter Blaha wrote:
>
>> Nothing is lost when a time limit kills your job.
>>
>> Usually you can just resubmit the next job (and put -NI into the run_lapw
>> command).
>>
>> For a higher k-mesh afterwards:
>>
>> save_lapw first_mesh
>> x kgen   (with more points)
>> run_lapw ...
>>
>>
>> On 07/13/2015 08:00 AM, lokanath patra wrote:
>>
>>> Dear users,
>>>     A supercell calculation with lower kpoints is running and it's
>>> converging very slowly.it <http://slowly.it> seems to take more time
>>> than I have given at the time of submission of the calculation.If the
>>> time gets over, it's not going to save any result.Is there any way to
>>> use the result of that calculation for higher kpoints during running??
>>>
>>> Thanks in advance.
>>>
>>> --
>>> Lokanath Patra
>>> Ph.D Scholar
>>> Dept. of Physics
>>> School of Applied and Basic Sciences
>>> Central University of Tamil Nadu
>>> Thiruvarur
>>> Tamil Nadu - 610101
>>> Ph no - +91-8675834507
>>>
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-- 
Lokanath Patra
Ph.D Scholar
Dept. of Physics
School of Applied and Basic Sciences
Central University of Tamil Nadu
Thiruvarur
Tamil Nadu - 610101
Ph no - +91-8675834507
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