MatHub-2d

Formula Gap (eV) Free Energy (eV) Crystal system Space group Comment
I2S2V2 0.15 -29.657 rectangular 59 MatHub2d-1576-I2S2V2
I2S2W2 0.00 -33.516 rectangular 59 MatHub2d-1577-I2S2W2
I2S2Zr2 0.01 -36.484 rectangular 59 MatHub2d-1578-I2S2Zr2
I2Sc2Se2 1.95 -29.457 rectangular 59 MatHub2d-1579-I2Sc2Se2
I2Se2Sn2 0.00 -20.042 rectangular 59 MatHub2d-1580-I2Se2Sn2
I2Se2Ta2 0.00 -33.130 rectangular 59 MatHub2d-1581-I2Se2Ta2
I2Se2Ti2 rectangular 59 MatHub2d-1582-I2Se2Ti2
I2Se2Tl2 0.00 -15.449 rectangular 59 MatHub2d-1583-I2Se2Tl2
I2Se2V2 0.52 -27.737 rectangular 59 MatHub2d-1584-I2Se2V2
I2Se2W2 0.00 -30.735 rectangular 59 MatHub2d-1585-I2Se2W2
I2Se2Zr2 0.00 -34.330 rectangular 59 MatHub2d-1586-I2Se2Zr2
I4Ir2 0.55 -17.993 rectangular 11 MatHub2d-1587-I4Ir2
I4Mo2 0.00 -22.576 rectangular 11 MatHub2d-1588-I4Mo2
I4Nb2 0.00 -24.963 rectangular 11 MatHub2d-1589-I4Nb2
I4O2Ta2 1.19 -46.877 rectangular 47 MatHub2d-1590-I4O2Ta2
I4Pd2 1.27 -14.508 rectangular 11 MatHub2d-1591-I4Pd2
I4Re2 0.43 -22.379 rectangular 11 MatHub2d-1592-I4Re2
I4Rh2 0.00 -15.965 rectangular 11 MatHub2d-1593-I4Rh2
I4Sc2 0.00 -22.741 rectangular 11 MatHub2d-1594-I4Sc2
I4Ta2 0.00 -27.136 rectangular 11 MatHub2d-1595-I4Ta2
I4Ti2 2.51 -22.398 rectangular 11 MatHub2d-1596-I4Ti2
I4W2 0.00 -24.855 rectangular 11 MatHub2d-1597-I4W2
I4Y2 0.00 -26.436 rectangular 11 MatHub2d-1598-I4Y2
I4Zr2 0.43 -28.516 rectangular 11 MatHub2d-1599-I4Zr2
I6U2 0.05 -37.971 rectangular 59 MatHub2d-1600-I6U2