GitHub - clovisguerim/Quantum-Espresso-Scripts: Here some scripts that was helpfull to deal with Quantum Espresso routines during my PhD. Some of those are made to work in LNCC (National Laboratory of Scientific Computing) architeture, a HCP with SLURM orchestration engine and some partitions used in it.

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Quantum-Espresso-Scripts

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Here some scripts that was helpfull to deal with Quantum Espresso routines during my PhD. Some of those are made to work in LNCC (National Laboratory of Scientific Computing) architeture, a HCP with SLURM orchestration engine and some partitions used in it.

dft hcp quantumespresso slurm

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