A simple walkthrough and template for NEB runs on VASP.
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Updated
Jan 28, 2022 - Shell
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vasp-calculations
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VASP structure relaxations bash and gnuplot scripts.
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Updated
Feb 1, 2023 - Shell
Shell scripts for automating VASP and SPR-KKR calculations, generating input files and extracting exchange-correlation energies.
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Updated
Nov 1, 2022 - Shell
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