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Add support for GIPAW_ORBITALS and GIPAW_VLOCAL#21

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Add support for GIPAW_ORBITALS and GIPAW_VLOCAL#21
azadoks wants to merge 1 commit into
JuliaMolSim:mainfrom
azadoks:upf2-gipaw

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@azadoks

@azadoks azadoks commented Feb 20, 2026

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ld1.x and ATOMPAW can write more information in the PP_GIPAW block than we currently parse; this is used, for example, in computing NMR tensors.
Some examples can be found here: https://github.com/dceresoli/gipaw-pseudopotentials.

@azadoks

azadoks commented Feb 20, 2026

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As a side note, if we moved to a more generic loading method à la upftools, this information would already have been parsed.

@azadoks azadoks marked this pull request as draft April 22, 2026 10:57
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