Installing QUANTUM ESPRESSO on UBUNTU

Описание: This video guides you through installing and building Quantum ESPRESSO 7.3.1 from the source code on Ubuntu 22.04 Jammy Jellyfish. We will install pseudopotentials and do a small SCF calculation of NaCl crystal using pw.x


By the end of this video, you'll be able to run your own Quantum ESPRESSO simulations!


What you'll learn:
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Install prerequisite software like Fortran compilers and libraries.
Download and configure Quantum ESPRESSO source code.
Downloading and adding pseudopotentials
(Bonus) Set up a simple SCF simulation of NaCl crystal.


Software used
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Ubuntu 22.04
Quantum ESPRESSO 7.3.1

Links used in this video
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Quantum Espresso: https://gitlab.com/QEF/q-e/-/archive/...
SSSP Precision (version 1.3.0): https://www.materialscloud.org/discov...
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Quantum espresso release: https://gitlab.com/QEF/q-e/-/releases

More pseudopotential libraries
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https://www.materialscloud.org/discov...
https://www.materialscloud.org/discov...
https://www.physics.rutgers.edu/gbrv/...
https://www.quantum-espresso.org/pseu...
https://www.pseudo-dojo.org

Website
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https://nhaloorsooraj.github.io


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