MatHub-3d

Formula Gap (eV) Free Energy (eV) Space group type Space group Comment Calculation progress
Cu5Gd1 0 -17.323 'P6/mmm' 191 MatHub3d-39683-Cu5Gd1 Band
Cu4Gd3Sn4 0 -44.514 'Immm' 71 MatHub3d-39192-Cu4Gd3Sn4 Band
Cu1Hf2 0 -22.583 'I4/mmm' 139 MatHub3d-37744-Cu1Hf2 Band
Cu1Hf1Hg2 0 -12.079 'F-43m' 216 MatHub3d-37742-Cu1Hf1Hg2 Band
Cu1Hg2Ti1 0 -6.664 'F-43m' 216 MatHub3d-37751-Cu1Hg2Ti1 Band
Cu1Hg2Zr1 0 -11.104 'F-43m' 216 MatHub3d-37752-Cu1Hg2Zr1 Band
Cu1Ho1 0.037 -7.313 'Pm-3m' 221 MatHub3d-37753-Cu1Ho1 Band
Cu4Ho2 0 -19.856 'Imma' 74 MatHub3d-39268-Cu4Ho2 Band
Cu5Ho1 0 -17.272 'F-43m' 216 MatHub3d-39687-Cu5Ho1 Band
Cu5Ho1 0 -17.213 'P6/mmm' 191 MatHub3d-39688-Cu5Ho1 Band
Cu2Ho1In1 0 -12.998 'Fm-3m' 225 MatHub3d-38349-Cu2Ho1In1 Band
Cu2In1La1 0 -12.962 'Fm-3m' 225 MatHub3d-38377-Cu2In1La1 Band
Cu2In1Lu1 0 -12.863 'Fm-3m' 225 MatHub3d-38378-Cu2In1Lu1 Band
Cu4In1Mg1 0 -14.019 'F-43m' 216 MatHub3d-39287-Cu4In1Mg1 Band
Cu2In1Mn1 0 -14.142 'Fm-3m' 225 MatHub3d-38379-Cu2In1Mn1 Band
Cu1H12N2O6Sn1 1.780 -112.493 'P-1' 2 MatHub3d-37736-Cu1H12N2O6Sn1 Band
Cs8S4 2.090 -35.215 'Pnma' 62 MatHub3d-37348-Cs8S4 Band
Cu2In1Nd1 0 -13.100 'Fm-3m' 225 MatHub3d-38380-Cu2In1Nd1 Band
Cu2In1Pr1 0 -13.071 'Fm-3m' 225 MatHub3d-38383-Cu2In1Pr1 Band
Cu2In1Sc1 0 -13.366 'Fm-3m' 225 MatHub3d-38384-Cu2In1Sc1 Band
Cu2In1Tb1 0 -13.052 'Fm-3m' 225 MatHub3d-38386-Cu2In1Tb1 Band
Cl8O9Re4 0.991 -121.325 'P-1' 2 MatHub3d-30020-Cl8O9Re4 Band
Cu2In1Ti1 0 -12.185 'Fm-3m' 225 MatHub3d-38387-Cu2In1Ti1 Band
Cu2In1Tm1 0 -12.931 'Fm-3m' 225 MatHub3d-38388-Cu2In1Tm1 Band
Cu2In1Y1 0 -14.942 'Fm-3m' 225 MatHub3d-38389-Cu2In1Y1 Band