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Bugfix in LargeSigmaHandler and expand vasp_gam auto checks #356

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esoteric-ephemera
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Two major changes:

  • Since LargeSigmaHandler is a monitor handler (checks while output is still being written), it can occasionally misfire when parsing data from OUTCAR. This adds a fix to prevent jobs from being terminated when the handler itself fails to interpret partial file output
  • Close #348 by expanding the scope of k-point checks to include KSPACING, and to also check for grid shifts in KPOINTS

@naik-aakash
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Thanks @esoteric-ephemera , was about to start working on adding the vasp gamma runs support when using KSPACING. Seems already in place 😃

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[Bug]: VASP GAMMA version not used when KSPACING is set in INCAR
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