Python framework for generating and validating pseudo potentials
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Updated
Nov 8, 2023 - HTML
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oncvpsp
Here are 5 public repositories matching this topic...
SPMS table of pseudopotentials
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Jan 22, 2023
The official repository of the oncvpsp code to generate optimized norm-conserving Vanderbilt pseudopotentials
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Jun 17, 2024 - Fortran
Pseudopotential converter from upf to psp8
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Jan 25, 2023 - Python
SG15 pseudopotentials in psp8 converted from the upf files
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Sep 24, 2022
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