[QE-users] Huge memory storage

[Rajneesh Chaurasiya]

Dear Paolo,
information needed are listed below.
Zval (Mo) = 14 and Zval (S) = 6
total number of K points = 301
number of bands = 500,
number of plane waves = 158472
number of g vector = 3335797

Thank you.


On Wed, Apr 25, 2018 at 5:12 PM, Rajneesh Chaurasiya <rajnano2012 at gmail.com>
wrote:

> Dear All,
>
> I did a calculation of 4*4 super cell of MoS2 in the order of scf, nscf
> and then band. and in the final i found that size of directory is around
> 1.3TB. How i minimize storage of data. because it is not possible to have
> such a huge memory.
> Is there any way how to do that. disk_io is the one option but its is
> possible to restart the job if interrupted suddenly.
>
> Thank you
>
>
> On Sat, Apr 21, 2018 at 10:28 AM, Rajneesh Chaurasiya <
> rajnano2012 at gmail.com> wrote:
>
>> Dear,
>>
>> I did a NSCF calculation of 4*4 supercell of MoS2,
>>
>> --
>> Thanks & Regards
>> Rajneesh Chaurasiya
>> Research Scholar
>> IIT Jodhpur, India
>> Mob. No. +91-9584499697
>>               +91-7610950803
>>
>
>
>
> --
> Thanks & Regards
> Rajneesh Chaurasiya
> Research Scholar
> IIT Jodhpur, India
> Mob. No. +91-9584499697
>               +91-7610950803
>



-- 
Thanks & Regards
Rajneesh Chaurasiya
Research Scholar
IIT Jodhpur, India
Mob. No. +91-9584499697
              +91-7610950803
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