MatHub-3d

Formula Gap (eV) Free Energy (eV) Space group type Space group Comment Calculation progress
Ga1Li2Pd1 0 -12.130 'F-43m' 216 MatHub3d-48621-Ga1Li2Pd1 Band
Ga1Ir1Li2 0 -14.679 'F-43m' 216 MatHub3d-48598-Ga1Ir1Li2 Band
In1Li2Rh1 0 -11.899 'F-43m' 216 MatHub3d-55464-In1Li2Rh1 Band
In1Ir1Li2 0 -13.610 'F-43m' 216 MatHub3d-55434-In1Ir1Li2 Band
In3Pt3Sm3 0 -36.382 'P-62m' 189 MatHub3d-55822-In3Pt3Sm3 Band
Hf4Ni4Sn2 0 -62.526 'P4/mbm' 127 MatHub3d-53788-Hf4Ni4Sn2 Band
Ag2La2Pb2 0 -21.107 'P6_3mc' 186 MatHub3d-865-Ag2La2Pb2 Band
Ag2Ce2Pb2 0 -21.194 'P6_3mc' 186 MatHub3d-646-Ag2Ce2Pb2 Band
Ag2Pb2Pr2 0 -20.991 'P6_3mc' 186 MatHub3d-950-Ag2Pb2Pr2 Band
Ag2Nd2Pb2 0 -20.920 'P6_3mc' 186 MatHub3d-916-Ag2Nd2Pb2 Band
Ag2Pb2Sm2 0 -20.686 'P6_3mc' 186 MatHub3d-951-Ag2Pb2Sm2 Band
Ag2Gd2Pb2 0 -20.480 'P6_3mc' 186 MatHub3d-771-Ag2Gd2Pb2 Band
Ag2Pb2Tb2 0 -20.348 'P6_3mc' 186 MatHub3d-952-Ag2Pb2Tb2 Band
Ag2Dy2Pb2 0 -20.208 'P6_3mc' 186 MatHub3d-696-Ag2Dy2Pb2 Band
Ag2Ho2Pb2 0 -20.068 'P6_3mc' 186 MatHub3d-803-Ag2Ho2Pb2 Band
Ge2Mn2Tb1 0 -29.362 'I4/mmm' 139 MatHub3d-50209-Ge2Mn2Tb1 Band
Ge2Mn2Tm1 0 -28.994 'I4/mmm' 139 MatHub3d-50211-Ge2Mn2Tm1 Band
Co4Ho4Si4 0 -62.124 'Pnma' 62 MatHub3d-32822-Co4Ho4Si4 Band
Co4Ge4Tb4 0 -58.902 'Pnma' 62 MatHub3d-32768-Co4Ge4Tb4 Band
Co1Sb1V1 0 -13.221 'F-43m' 216 MatHub3d-31605-Co1Sb1V1 Band
Cu1Pt1 0 -6.719 'R-3m' 166 MatHub3d-37996-Cu1Pt1 Band
Bi1Ni1Zr1 0 -15.830 'F-43m' 216 MatHub3d-15645-Bi1Ni1Zr1 Band
Nb1Rh1Sb1 0 -17.617 'F-43m' 216 MatHub3d-66725-Nb1Rh1Sb1 Band
Ru1Sb1V1 0.659 -16.833 'F-43m' 216 MatHub3d-72724-Ru1Sb1V1 Transport
Hf1Ru1Sb1 0 -21.365 'F-43m' 216 MatHub3d-53635-Hf1Ru1Sb1 Band