Re: [QE-users] Supercell and surface creation

[Zack Gainsforth]

Also atomsk is good for this type of task.  https://atomsk.univ-lille.fr/

Zack

> On Mar 24, 2023, at 4:55 AM, mkondrin  wrote:
> 
> On 03/24/2023 02:51 PM, IBRAHIM SA'ADU wrote:
>> Please how can create a 5x5x1 supercell and (0,0,1) surface.
>> Regard
>> 
>> 
>> 
>> ___
>> The Quantum ESPRESSO community stands by the Ukrainian
>> people and expresses its concerns about the devastating
>> effects that the Russian military offensive has on their
>> country and on the free and peaceful scientific, cultural,
>> and economic cooperation amongst peoples
>> ___
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu 
>> )
>> users mailing list users@lists.quantum-espresso.org 
>> 
>> https://lists.quantum-espresso.org/mailman/listinfo/users
> Hi,
> 
> Learn more about cif2cell utility.
> 
> Hope this helps,
> 
> Regards,
> 
> M. V. Kondrin
> 
> ___
> The Quantum ESPRESSO community stands by the Ukrainian
> people and expresses its concerns about the devastating
> effects that the Russian military offensive has on their
> country and on the free and peaceful scientific, cultural,
> and economic cooperation amongst peoples
> ___
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users@lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users

___
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users

Re: [QE-users] Supercell and surface creation

[mkondrin]

On 03/24/2023 02:51 PM, IBRAHIM SA'ADU wrote:

Please how can create a 5x5x1 supercell and (0,0,1) surface.
Regard



___
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users


Hi,

Learn more about cif2cell utility.

Hope this helps,

Regards,

M. V. Kondrin

___
The Quantum ESPRESSO community stands by the Ukrainian
people and expresses its concerns about the devastating
effects that the Russian military offensive has on their
country and on the free and peaceful scientific, cultural,
and economic cooperation amongst peoples
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users