Crystallographic data | Sstructural stability [Footnotes] | Magnetic properties [Footnotes, magnetic units] | Methods | References | ||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Materials ID | Formula | Formula units per cell | Atomic sites per cell | Crystal system | Space group [Number] | Formation energy (eV/atom) | Energy relative to convex hull (eV/atom) | Structure search | Averaged magnetic moment (μB/atom) | Magnetic polarization, Js (T) | Magnetic easy axis | Magnetic anisotropy constants: Ka-c, Kb-c, Kb-a, Kd-a (MJ/m3) |
Curie temperature, TC (K) | Methods | References | |||
MMD-2849 | MnSiP2 | 4 | 16 | tetragonal | I-42d [122] | -0.101 | . | MP | 1.20 | 0.70 | . | . | . | . | . | . | DFT | mp-1207203 |
MMD-2931 | Mn31Si11P | 1 | 43 | trigonal | P3 [143] | -0.221 | . | MP | 0.90 | 0.90 | . | . | . | . | . | . | DFT | mp-1222619 |
MMD-2925 | Mn12SiP3 | 1 | 16 | triclinic | P1 [1] | -0.307 | . | MP | 0.33 | 0.34 | . | . | . | . | . | . | DFT | mp-1222102 |