[QE-users] Calculation of Elastic constants

MEGHA GOYAL megha3294 at gmail.com
Wed Mar 14 08:37:17 CET 2018


Dear Sir,
Can you tell me where I can get tutorials of this package.

Thank you

--------------------------------------------------------------------------------
Megha Goyal
Research Scholar
Department of Physics
Sant Longowal Inst. of Engg. & Tech.
(Deemed University, Under MHRD, Govt. of India)
Longowal, Sangrur -148106 (Punjab), India
---------------------------------------------------------------------------------

On Tue, Mar 13, 2018 at 7:07 PM, 殷顺高 <yinshungao at gmail.com> wrote:

> Dear Megha Goyal,
> thermo_pw package in Quantum Espresso suite may do what you want.
>
> Best wishes,
>
>
> 2018-03-13 19:01 GMT+08:00 MEGHA GOYAL <megha3294 at gmail.com>:
>
>> Dear Sam,
>>
>> Thanks a lot for your help
>>
>> ------------------------------------------------------------
>> --------------------
>> Megha Goyal
>> Research Scholar
>> Department of Physics
>> Sant Longowal Inst. of Engg. & Tech.
>> (Deemed University, Under MHRD, Govt. of India)
>> Longowal, Sangrur -148106 (Punjab), India
>> ------------------------------------------------------------
>> ---------------------
>>
>> On Tue, Mar 13, 2018 at 4:17 PM, Azadi, Sam <s.azadi at imperial.ac.uk>
>> wrote:
>>
>>> This may help:
>>> http://iopscience.iop.org/article/10.1088/0953-8984/28/7/075401/meta
>>>
>>> Best,
>>> Sam
>>> ----------------------------------
>>> Imperial College London
>>>
>>> On 13 Mar 2018, at 10:42, MEGHA GOYAL <megha3294 at gmail.com> wrote:
>>>
>>> Dear Experts,
>>> I want to calculate elastic constants.
>>> Can anyone guide me for that.
>>>
>>>
>>> Thanks,
>>> ------------------------------------------------------------
>>> --------------------
>>> Megha Goyal
>>> Research Scholar
>>> Department of Physics
>>> Sant Longowal Inst. of Engg. & Tech.
>>> (Deemed University, Under MHRD, Govt. of India)
>>> Longowal, Sangrur -148106 (Punjab), India
>>> ------------------------------------------------------------
>>> ---------------------
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>>
>>
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>
>
>
> --
> -------------------------------------
> Dr. Shungao  Yin
> Email: yinshungao at gmail.com <sgyin at semi.ac.cn>
> College of Chemistry and Chemical Engineering,
> Jiangxi Normal University,
> Nanchang 330004, P.R.China
> -------------------------------------
>
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