QE7.6 XSpectra C8 dipole XANES. Cached data: module load ase/3.29.0; bash read.sh; bash plot.sh. Fresh own calculations: bash prepare.sh; sbatch --chdir="$PWD" job.slurm; after completion bash read.sh work-new analysis-new;bash plot.sh analysis-new. Two SCFs, no-hole/core-hole with32valence electrons each. core-hole uses one Ch valence5 pseudopotential and tot_charge+1. Small charged8atom periodic model, not dilute converged or absolute edge prediction. Core and PP not distributed, pinned official fetch with hashes; GPL core extraction helper plus QE license included. Cached identical replot verified; changing polarization requires new Lanczos savefile, not replot only. Native energy axis uses each own HOMO; no absolute alignment. Native sigma units retained unassigned.
