MatHub-2d

Formula Gap (eV) Free Energy (eV) Crystal system Space group Comment
Ba2N1 0.00 -12.839 hexagonal 164 MatHub2d-101-Ba2N1
Bi14S8Te13 hexagonal 147 MatHub2d-102-Bi14S8Te13
Bi1Cl1Te1 1.74 -10.640 hexagonal 156 MatHub2d-103-Bi1Cl1Te1
Bi1Cu1P2Se6 1.15 -39.913 hexagonal 149 MatHub2d-104-Bi1Cu1P2Se6
Bi1I1Te1 1.55 -9.653 hexagonal 156 MatHub2d-105-Bi1I1Te1
Bi1O2 0.42 -15.192 hexagonal 187 MatHub2d-106-Bi1O2
Bi2Br6 2.99 -23.769 hexagonal 162 MatHub2d-107-Bi2Br6
Bi2Br6 2.74 -23.282 hexagonal 189 MatHub2d-108-Bi2Br6
Bi2C6 0.00 -53.683 hexagonal 191 MatHub2d-109-Bi2C6
Bi2Cl6 3.21 -26.347 hexagonal 191 MatHub2d-110-Bi2Cl6
Bi2Cl6 3.37 -26.732 hexagonal 162 MatHub2d-111-Bi2Cl6
Bi2F2O2 3.45 -32.045 hexagonal 164 MatHub2d-112-Bi2F2O2
Bi2Ge1Te4 0.98 -26.152 hexagonal 164 MatHub2d-113-Bi2Ge1Te4
Bi2Ge6 0.00 -29.057 hexagonal 191 MatHub2d-114-Bi2Ge6
Bi2I6 2.56 -20.745 hexagonal 162 MatHub2d-115-Bi2I6
Bi2I6 2.39 -20.099 hexagonal 189 MatHub2d-116-Bi2I6
Bi2O2 0.91 -20.468 hexagonal 187 MatHub2d-117-Bi2O2
Bi2Pb1Se4 0.93 -28.414 hexagonal 164 MatHub2d-118-Bi2Pb1Se4
Bi2Pb1Te4 1.02 -25.871 hexagonal 164 MatHub2d-119-Bi2Pb1Te4
Bi2Pb2Se5 0.80 -36.593 hexagonal 164 MatHub2d-120-Bi2Pb2Se5
Bi2Pb6 0.00 -23.458 hexagonal 191 MatHub2d-121-Bi2Pb6
Bi2S1Te2 0.93 -19.605 hexagonal 164 MatHub2d-122-Bi2S1Te2
Bi2S2 0.65 -15.780 hexagonal 187 MatHub2d-123-Bi2S2
Bi2Se1Te2 0.87 -19.058 hexagonal 164 MatHub2d-124-Bi2Se1Te2
Bi2Se2 0.43 -14.718 hexagonal 187 MatHub2d-125-Bi2Se2