MatHub-3d

Formula Gap (eV) Free Energy (eV) Space group type Space group Comment Calculation progress
Ga12La2 0 -48.703 'P4/nbm' 125 MatHub3d-49335-Ga12La2 Band
Ga2La3Ni4 0 -33.351 'C2/m' 12 MatHub3d-48792-Ga2La3Ni4 Band
Ga2Np1 0 -18.940 'P6/mmm' 191 MatHub3d-48842-Ga2Np1 Band
Ga2Li2 0 -10.758 'Fd-3m' 227 MatHub3d-48800-Ga2Li2 Band
Ga3Np1 0 -22.103 'Pm-3m' 221 MatHub3d-48927-Ga3Np1 Band
Ga1Li1Mg2 0 -8.407 'Fm-3m' 225 MatHub3d-48610-Ga1Li1Mg2 Band
Ga1Li1Si1 0.126 -10.611 'F-43m' 216 MatHub3d-48618-Ga1Li1Si1 Band
Ga8Mg8 0 -37.097 'I4_1/a' 88 MatHub3d-49244-Ga8Mg8 Band
Ga6Mg12 0 -37.306 'P-62c' 190 MatHub3d-49169-Ga6Mg12 Band
Ga4Mg2 0 -15.120 'P6_3/mmc' 194 MatHub3d-49029-Ga4Mg2 Band
Ga4Mg10 0 -27.985 'Ibam' 72 MatHub3d-49034-Ga4Mg10 Band
Ba2Cl1Cu1O2 2.652 -30.698 'R-3m' 166 MatHub3d-12385-Ba2Cl1Cu1O2 Band
Ge6K2O18Ta2 3.507 -195.848 'P-6c2' 188 MatHub3d-50747-Ge6K2O18Ta2 Transport
Ga2Mn2Pt2 0 -31.184 'P6_3/mmc' 194 MatHub3d-48819-Ga2Mn2Pt2 Band
Ge6O18Rb2Ta2 3.474 -195.740 'P-6c2' 188 MatHub3d-50812-Ge6O18Rb2Ta2 Transport
Ga2Mo6 0 -55.784 'Pm-3n' 223 MatHub3d-48823-Ga2Mo6 Band
Ge6Nb2O18Rb2 3.368 -191.133 'P-6c2' 188 MatHub3d-50794-Ge6Nb2O18Rb2 Transport
Ga1N1Nd3 0 -20.583 'Pm-3m' 221 MatHub3d-48657-Ga1N1Nd3 Band
Ga4Na1 0 -13.417 'I4/mmm' 139 MatHub3d-49038-Ga4Na1 Band
Ga4Pd2Tm2 0 -33.229 'Cmcm' 63 MatHub3d-49089-Ga4Pd2Tm2 Band
Ge6O18Ta2Tl2 3.731 -194.120 'P-6c2' 188 MatHub3d-50815-Ge6O18Ta2Tl2 Transport
Ga2Nb6 0 -57.038 'Pm-3n' 223 MatHub3d-48835-Ga2Nb6 Band
Ga4Nb6 0 -65.561 'P4/mbm' 127 MatHub3d-49045-Ga4Nb6 Band
Ga3Nb1 0 -18.289 'I4/mmm' 139 MatHub3d-48919-Ga3Nb1 Band
Ga6Nb10 0 -102.222 'I4/mcm' 140 MatHub3d-49176-Ga6Nb10 Band