On this page you can find the repo with the workshop materials.

Lecture 1: Introduction to PERTURBO

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Lecture 2: Workflow, qe2pert interface

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Lecture 3: Transport

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Lecture 4: Compiling with GPU shown on NERSC

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Hands-on 1: Download and installation

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Click here to see a GitHub with tutorial materials.




Hands-on 2: PerturboPy

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Hands-on 3: qe2pert, epr generation

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Hands-on 4: Transport

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Lecture 5 + Hands-on 5: Ultrafast dynamics

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Click here to see a GitHub with hands-on materials.




Lecture 6 + Hands-on 6: SOC + spin relaxation time

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Hands-on 7: Anharmonic phonons

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Lecture 8 + Hands-on 5: DFT+U/DFPT+U

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Click here to see a GitHub with hands-on materials.