AFLOW Prototype: AB11CD3_cP16_221_a_dg_b_c
Prototype | : | CrFe11MoNi3 |
AFLOW prototype label | : | AB11CD3_cP16_221_a_dg_b_c |
Strukturbericht designation | : | None |
Pearson symbol | : | cP16 |
Space group number | : | 221 |
Space group symbol | : | $\text{Pm}\bar{3}\text{m}$ |
AFLOW prototype command | : | aflow --proto=AB11CD3_cP16_221_a_dg_b_c --params=$a$,$x_{5}$ |
Basis vectors:
\[ \begin{array}{ccccccc} & & \text{Lattice Coordinates} & & \text{Cartesian Coordinates} &\text{Wyckoff Position} & \text{Atom Type} \\ \mathbf{B}_{1} & = &0 \, \mathbf{a}_{1} + 0 \, \mathbf{a}_{2} + 0 \, \mathbf{a}_{3} & = &0 \mathbf{\hat{x}} + 0 \mathbf{\hat{y}} + 0 \mathbf{\hat{z}} & \left(1a\right) & \text{Cr} \\ \mathbf{B}_{2} & = &\frac12 \, \mathbf{a}_{1}+ \frac12 \, \mathbf{a}_{2}+ \frac12 \, \mathbf{a}_{3}& = &\frac12 \, a \, \mathbf{\hat{x}}+ \frac12 \, a \, \mathbf{\hat{y}}+ \frac12 \, a \, \mathbf{\hat{z}}& \left(1b\right) & \text{Mo} \\ \mathbf{B}_{3} & = &\frac12 \, \mathbf{a}_{2}+ \frac12 \, \mathbf{a}_{3}& = &\frac12 \, a \, \mathbf{\hat{y}}+ \frac12 \, a \, \mathbf{\hat{z}}& \left(3c\right) & \text{Ni} \\ \mathbf{B}_{4} & = &\frac12 \, \mathbf{a}_{1}+ \frac12 \, \mathbf{a}_{3}& = &\frac12 \, a \, \mathbf{\hat{x}}+ \frac12 \, a \, \mathbf{\hat{z}}& \left(3c\right) & \text{Ni} \\ \mathbf{B}_{5} & = &\frac12 \, \mathbf{a}_{1}+ \frac12 \, \mathbf{a}_{2}& = &\frac12 \, a \, \mathbf{\hat{x}}+ \frac12 \, a \, \mathbf{\hat{y}}& \left(3c\right) & \text{Ni} \\ \mathbf{B}_{6} & = &\frac12 \, \mathbf{a}_{1}& = &\frac12 \, a \, \mathbf{\hat{x}}& \left(3d\right) & \text{Fe I} \\ \mathbf{B}_{7} & = &\frac12 \, \mathbf{a}_{2}& = &\frac12 \, a \, \mathbf{\hat{y}}& \left(3d\right) & \text{Fe I} \\ \mathbf{B}_{8} & = &\frac12 \, \mathbf{a}_{3}& = &\frac12 \, a \, \mathbf{\hat{z}}& \left(3d\right) & \text{Fe I} \\ \mathbf{B}_{9} & = &x_{5} \, \mathbf{a}_{1}+ x_{5} \, \mathbf{a}_{2}+ x_{5} \, \mathbf{a}_{3}& = &x_{5} \, a \, \mathbf{\hat{x}}+ x_{5} \, a \, \mathbf{\hat{y}}+ x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{10} & = &- x_{5} \, \mathbf{a}_{1}- x_{5} \, \mathbf{a}_{2}+ x_{5} \, \mathbf{a}_{3}& = &- x_{5} \, a \, \mathbf{\hat{x}}- x_{5} \, a \, \mathbf{\hat{y}}+ x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{11} & = &- x_{5} \, \mathbf{a}_{1}+ x_{5} \, \mathbf{a}_{2}- x_{5} \, \mathbf{a}_{3}& = &- x_{5} \, a \, \mathbf{\hat{x}}+ x_{5} \, a \, \mathbf{\hat{y}}- x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{12} & = &x_{5} \, \mathbf{a}_{1}- x_{5} \, \mathbf{a}_{2}- x_{5} \, \mathbf{a}_{3}& = &x_{5} \, a \, \mathbf{\hat{x}}- x_{5} \, a \, \mathbf{\hat{y}}- x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{13} & = &x_{5} \, \mathbf{a}_{1}+ x_{5} \, \mathbf{a}_{2}- x_{5} \, \mathbf{a}_{3}& = &x_{5} \, a \, \mathbf{\hat{x}}+ x_{5} \, a \, \mathbf{\hat{y}}- x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{14} & = &- x_{5} \, \mathbf{a}_{1}- x_{5} \, \mathbf{a}_{2}- x_{5} \, \mathbf{a}_{3}& = &- x_{5} \, a \, \mathbf{\hat{x}}- x_{5} \, a \, \mathbf{\hat{y}}- x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{15} & = &x_{5} \, \mathbf{a}_{1}- x_{5} \, \mathbf{a}_{2}+ x_{5} \, \mathbf{a}_{3}& = &x_{5} \, a \, \mathbf{\hat{x}}- x_{5} \, a \, \mathbf{\hat{y}}+ x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \mathbf{B}_{16} & = &- x_{5} \, \mathbf{a}_{1}+ x_{5} \, \mathbf{a}_{2}+ x_{5} \, \mathbf{a}_{3}& = &- x_{5} \, a \, \mathbf{\hat{x}}+ x_{5} \, a \, \mathbf{\hat{y}}+ x_{5} \, a \, \mathbf{\hat{z}}& \left(8g\right) & \text{Fe II} \\ \end{array} \]