C6Hg2N6Rb2S6

MatHub3d-21028-C6Hg2N6Rb2S6

Property Value
Space group (11, "'P2_1/m'")
Magnetic True
Magnetic moment (μB) 0.06
Band gap (PBE) (eV) 2.02
Total energy (eV) -132.121
Total energy / atom (eV) -6.006

Lattice Parameters(from the source)

a, b, c (Å): 11.100 4.170 11.410
α, β, γ(°): 90.0 115.0 90.0

Lattice Parameters(computed)

a, b, c (Å): 11.520 4.320 11.670
α, β, γ(°): 90.0 114.0 90.0

Deformation Potential

n_type (eV): -0.473
p_type (eV): 2.281
C6Hg2N6Rb2S6
.
Property Value
Bulk-modulus 62.097 GPa






C6Hg2N6Rb2S6
  
Property Value
Band gap 2.02 eV
Band degeneracy(CBM) 1.00
Band degeneracy(VBM) 1.00
Property Value
Source icsd-101-C6Hg2N6Rb2S6