Dear Fariba, try to use Burai code, is a GUI of QuantumEspresso, a friendly tool to build supercell.
https://nisihara.wixsite.com/burai Best Dr. Arles V. Gil Rebaza Instituto de Física La Plata La Plata - Argentina El mar., 5 may. 2020 a las 4:21, Offermans Willem (<[email protected]>) escribió: > Hi Fariba and Quantum Espresso friends, > > Are you aware of the following files in the source: > > /qe-6.4.1/COUPLE/examples/README > /qe-6.4.1/CPV/examples/README > /qe-6.4.1/GWW/examples/README > /qe-6.4.1/HP/examples/README > /qe-6.4.1/PHonon/examples/README > /qe-6.4.1/PP/examples/README > /qe-6.4.1/PW/examples/README > /qe-6.4.1/TDDFPT/examples/README > /qe-6.4.1/thermo_pw/examples/README > > I guess that especially > > /qe-6.4.1/PW/examples/README > > is of interest for you. > > > Met vriendelijke groeten, > Mit freundlichen Grüßen, > With kind regards, > > > Willem Offermans > Researcher Electrocatalysis SCT > VITO NV | Boeretang 200 | 2400 Mol > Phone:+32(0)14335263 Mobile:+32(0)492182073 > > [email protected] > > > On 5 May 2020, at 07:51, Fariba Islam <[email protected]> wrote: > > Dear users, > I am new to Quantum Espresso and have a very naive question. Can anyone > please tell me how can I create a supercell of silicon fcc crystal? > > Regards > Fariba Islam > _______________________________________________ > Quantum ESPRESSO is supported by MaX ( > https://eur02.safelinks.protection.outlook.com/?url=http%3A%2F%2Fwww.max-centre.eu%2Fquantum-espresso&data=02%7C01%7Cwillem.offermans%40vito.be%7C6bf02fcb40fd432a4bf308d7f0b87c4d%7C9e2777ed82374ab992782c144d6f6da3%7C0%7C0%7C637242547457789642&sdata=ifMUhIiPXZ8XLKxNyu3DqxtfOhQOCwLKpOEDn608q6E%3D&reserved=0 > ) > users mailing list [email protected] > > https://eur02.safelinks.protection.outlook.com/?url=https%3A%2F%2Flists.quantum-espresso.org%2Fmailman%2Flistinfo%2Fusers&data=02%7C01%7Cwillem.offermans%40vito.be%7C6bf02fcb40fd432a4bf308d7f0b87c4d%7C9e2777ed82374ab992782c144d6f6da3%7C0%7C0%7C637242547457789642&sdata=3pAE8mKiWf6IWmx92U6o2XEWt2A9Vng%2FcepFVhcuk7Y%3D&reserved=0 > > > VITO Disclaimer: http://www.vito.be/e-maildisclaimer > _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso) > users mailing list [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users
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