Found 19369 rows out of 19369, showing rows 1-25

Unique ID age Formula Energy [eV] pbc Unit cell volume [Å3] charge Direct bandgap GLLB-SC [eV] Indirect bandgap GLLB-SC [eV] Heat of formation [eV]
1 TiAsNO2 -31.366 60.302 0.000 0.000 1.200
2 SbKNO2 -24.823 69.073 0.000 0.000 0.600
3 HgNbNO2 -31.495 70.421 1.600 1.000 0.540
4 BiSbNO2 -25.944 71.053 0.000 0.000 0.880
5 AgNaNO2 -17.664 73.669 0.000 0.000 1.780
6 CsBeNO2 -16.774 76.236 0.000 0.000 2.580
7 BiCuNO2 -23.533 60.684 0.000 0.000 1.200
8 BiMgNO2 -24.431 68.019 0.000 0.000 1.020
9 TaSiNO2 -35.519 46.633 0.000 0.000 1.220
10 ZrRuNO2 -36.529 64.412 0.000 0.000 1.240
11 WTlNO2 -22.589 73.523 0.000 0.000 2.600
12 WZnNO2 -31.958 62.296 0.000 0.000 0.520
13 RbTeNO2 -11.685 84.948 0.000 0.000 2.960
14 MoGeNO2 -31.659 53.823 0.000 0.000 1.140
15 AuVNO2 -29.080 60.932 0.000 0.000 1.020
16 NiAsNO2 -27.940 52.561 0.000 0.000 1.180
17 CsHfNO2 -32.042 82.590 0.000 0.000 0.720
18 ScBeNO2 -26.084 66.079 0.000 0.000 2.300
19 AlBeNO2 -25.750 50.319 0.000 0.000 1.920
20 PdMgNO2 -19.196 61.001 0.000 0.000 1.960
21 MnAsNO2 -30.978 52.937 0.000 0.000 1.040
22 HfZrNO2 -42.138 71.807 0.000 0.000 0.540
23 OsYNO2 -36.966 62.170 0.000 0.000 1.100
24 HgPdNO2 -13.667 77.089 0.000 0.000 2.500
25 HfSrNO2 -36.956 73.837 0.000 0.000 0.240
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