Recent content by Alessandroocj

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    A Quantum Espresso Tutorial: h-Boron Phosphide Variable-Cell Relaxation

    Hello my dear fellows, how're you doing? I'm trying to learn how to use Quantum Espresso, and in order to do this, I'm trying to simulate a hexagonal boron phosphide primary cell. At the end of the simulation, the structure seems to be fine, but sometimes the distance of the atoms are too short...
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