MatHub-3d

Formula Gap (eV) Free Energy (eV) Space group type Space group Comment Calculation progress
Dy1Sb1 0 -10.941 'Fm-3m' 225 MatHub3d-40487-Dy1Sb1 Band
B4F28S4 5.016 -172.454 'Pnma' 62 MatHub3d-9478-B4F28S4 Transport
Dy1Sn3 0 -17.786 'Pm-3m' 221 MatHub3d-40494-Dy1Sn3 Band
Dy10Sn6 0 -79.746 'P6_3/mcm' 193 MatHub3d-40868-Dy10Sn6 Band
Dy1Tl1 0 -7.443 'Pm-3m' 221 MatHub3d-40498-Dy1Tl1 Band
Dy1Tl3 0 -12.078 'Pm-3m' 221 MatHub3d-40499-Dy1Tl3 Band
Dy4Tl2 0 -24.178 'P6_3/mmc' 194 MatHub3d-40762-Dy4Tl2 Band
Dy1Zn1 0 -5.476 'Pm-3m' 221 MatHub3d-40501-Dy1Zn1 Band
As6S6 0 -51.127 'Cmc2_1' 36 MatHub3d-6559-As6S6 Band
Dy4Zn12 0 -27.159 'Pnma' 62 MatHub3d-40763-Dy4Zn12 Band
Dy4Zn34 0 -39.019 'P6_3/mmc' 194 MatHub3d-40764-Dy4Zn34 Band
Dy2Zn17 0 -19.523 'R-3m' 166 MatHub3d-40617-Dy2Zn17 Band
Eu1Ga2 0 -9.308 'P6/mmm' 191 MatHub3d-41460-Eu1Ga2 Band
B16H64U4 0.266 -380.267 'P4_32_12' 96 MatHub3d-11091-B16H64U4 Transport
Eu1Ga4 0 -15.853 'I4/mmm' 139 MatHub3d-41461-Eu1Ga4 Band
Eu6Ga10 0 -49.660 'Amm2' 38 MatHub3d-41878-Eu6Ga10 Band
Eu3Ga8 0 -34.485 'Immm' 71 MatHub3d-41700-Eu3Ga8 Band
Eu3Ga4Ni4 0 -32.893 'I-43m' 217 MatHub3d-41699-Eu3Ga4Ni4 Band
Eu1Hg1 0 -3.459 'Pm-3m' 221 MatHub3d-41483-Eu1Hg1 Band
Eu1Hg2 0 -4.014 'P6/mmm' 191 MatHub3d-41484-Eu1Hg2 Band
Eu2In4 0 -16.964 'P6_3/mmc' 194 MatHub3d-41599-Eu2In4 Band
Ag6Rb2S4 0.646 -29.485 'C2/m' 12 MatHub3d-1574-Ag6Rb2S4 Band
Eu4In4Pd4 0 -40.415 'Pnma' 62 MatHub3d-41766-Eu4In4Pd4 Band
Eu8Ir2 0 -31.201 'I4_1/amd' 141 MatHub3d-41926-Eu8Ir2 Band
Eu4Mg8 0 -20.983 'P6_3/mmc' 194 MatHub3d-41792-Eu4Mg8 Band