OSC open submissions: Br6Ru2, NV2 (measured; corrected-band dual scores)

#32
submissions/WiktorMatuszek_OSC-01313.json ADDED
@@ -0,0 +1,14 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "author": "WiktorMatuszek",
3
+ "material_id": "1NV2-1",
4
+ "osc_id": "OSC-01313",
5
+ "formula": "NV2",
6
+ "method_name": "Keraunos: organizer-equal QE PBE SCF non-spin-polarized (6x6x1, pslibrary PAW) + OSC downfold.py",
7
+ "provisional_score": 9.74,
8
+ "nef": 1.427,
9
+ "score_current_pipeline": 9.74,
10
+ "score_corrected_same_band": 23.84,
11
+ "band_filling_per_spin_fullest": 0.4338,
12
+ "track": "open",
13
+ "note": "Correction (post-convention-fix): this uid is in the active set, so canonical values apply (nef=0.555, n_band=0.746, score 9.74). My organizer-equal QE measured nef=1.427 at 2f=0.868 on the same band; kept here for the record, not a discovery claim."
14
+ }
submissions/WiktorMatuszek_OSC-01897.json ADDED
@@ -0,0 +1,14 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "author": "WiktorMatuszek",
3
+ "material_id": "2RuBr3-1",
4
+ "osc_id": "OSC-01897",
5
+ "formula": "Br6Ru2",
6
+ "method_name": "Keraunos: organizer-equal QE PBE SCF non-spin-polarized (6x6x1, pslibrary PAW) + OSC downfold.py",
7
+ "provisional_score": 2.52,
8
+ "nef": 1.738,
9
+ "score_current_pipeline": 2.52,
10
+ "score_corrected_same_band": 30.5,
11
+ "band_filling_per_spin_fullest": 0.3616,
12
+ "track": "open",
13
+ "note": "New material outside the active set. Measured organizer-equal QE; dual score under the per-spin convention of #15 included for completeness."
14
+ }