[Pw_forum] smearing convergence

Manoj Narayanan manojnarayan86 at gmail.com
Tue Dec 31 06:36:35 CET 2013


Dear Manu

Thanks for the quick reply. I want to do some calculation in Al bulk (FCC)
for that I want to get the appropriate value of smearing (since Al is a
metal)  through convergence test.  I want to know the procedure for that .


On Tue, Dec 31, 2013 at 10:44 AM, Manu Hegde <mhegde at uwaterloo.ca> wrote:

> What do you mean by that?.  Post you input data as well.
>
>
> On Tue, Dec 31, 2013 at 12:00 AM, Manoj Narayanan <
> manojnarayan86 at gmail.com> wrote:
>
>> Dear all
>>
>> I am new to Quantum Espresso. Can somebody tell how to do the convergence
>> test for smearing ?
>>
>> With regards
>> Manoj N H
>> Allahabad Uty.
>>
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>
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