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CuS2 (OSC-00581) baseline at corrected filling delta=|1-2*n_band| — see #15
#16
by Yuseon84 - opened
Baseline entry for CuS2 (1CuS2-3, OSC-00581) evaluated at the corrected filling discussed in #15:
the pipeline's n_band = 0.478 is the per-spin filling of the active band, so the density is
n = 2 × 0.478 = 0.956 and δ = 0.044 → Ne = 34, A_d = 0.04523, index = 1.666 × 0.04523 × 300 = 22.6.
Under the current pipeline this material is scored 0 ("overdoped, δ = 0.556"); this file records the
value it takes if the filling convention is corrected. No claim beyond the published A_d table is made.
Format follows the existing submissions/ entries.
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