AFLOW Prototype: AB8C2_tP11_123_a_ehi_g-003
If you are using this page, please cite:
H. Eckert, S. Divilov, M. J. Mehl, D. Hicks, A. C. Zettel, M. Esters. X. Campilongo and S. Curtarolo, The AFLOW Library of Crystallographic Prototypes: Part 4. Submitted to Computational Materials Science.
Links to this page
https://aflow.org/p/G7WP
or
https://aflow.org/p/AB8C2_tP11_123_a_ehi_g-003
or
PDF Version
Prototype | CoGa$_{8}$Ho$_{2}$ |
AFLOW prototype label | AB8C2_tP11_123_a_ehi_g-003 |
ICSD | 198243 |
Pearson symbol | tP11 |
Space group number | 123 |
Space group symbol | $P4/mmm$ |
AFLOW prototype command |
aflow --proto=AB8C2_tP11_123_a_ehi_g-003
--params=$a, \allowbreak c/a, \allowbreak z_{3}, \allowbreak z_{4}, \allowbreak z_{5}$ |
Ce$_{2}$PdIn$_{8}$, Ce$_{2}$PtIn$_{8}$, Ho$_{2}$DyGa$_{8}$, Ho$_{2}$ErGa$_{8}$, Ho$_{2}$GdGa$_{8}$, Ho$_{2}$LuGa$_{8}$, Ho$_{2}$SmGa$_{8}$, Ho$_{2}$TbGa$_{8}$, Ho$_{2}$TmGa$_{8}$, Ho$_{2}$YGa$_{8}$
Basis vectors
Lattice coordinates | Cartesian coordinates | Wyckoff position | Atom type | |||
---|---|---|---|---|---|---|
$\mathbf{B_{1}}$ | = | $0$ | = | $0$ | (1a) | Co I |
$\mathbf{B_{2}}$ | = | $\frac{1}{2} \, \mathbf{a}_{2}+\frac{1}{2} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{y}}+\frac{1}{2}c \,\mathbf{\hat{z}}$ | (2e) | Ga I |
$\mathbf{B_{3}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}+\frac{1}{2} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{x}}+\frac{1}{2}c \,\mathbf{\hat{z}}$ | (2e) | Ga I |
$\mathbf{B_{4}}$ | = | $z_{3} \, \mathbf{a}_{3}$ | = | $c z_{3} \,\mathbf{\hat{z}}$ | (2g) | Ho I |
$\mathbf{B_{5}}$ | = | $- z_{3} \, \mathbf{a}_{3}$ | = | $- c z_{3} \,\mathbf{\hat{z}}$ | (2g) | Ho I |
$\mathbf{B_{6}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}+\frac{1}{2} \, \mathbf{a}_{2}+z_{4} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{x}}+\frac{1}{2}a \,\mathbf{\hat{y}}+c z_{4} \,\mathbf{\hat{z}}$ | (2h) | Ga II |
$\mathbf{B_{7}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}+\frac{1}{2} \, \mathbf{a}_{2}- z_{4} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{x}}+\frac{1}{2}a \,\mathbf{\hat{y}}- c z_{4} \,\mathbf{\hat{z}}$ | (2h) | Ga II |
$\mathbf{B_{8}}$ | = | $\frac{1}{2} \, \mathbf{a}_{2}+z_{5} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{y}}+c z_{5} \,\mathbf{\hat{z}}$ | (4i) | Ga III |
$\mathbf{B_{9}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}+z_{5} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{x}}+c z_{5} \,\mathbf{\hat{z}}$ | (4i) | Ga III |
$\mathbf{B_{10}}$ | = | $\frac{1}{2} \, \mathbf{a}_{2}- z_{5} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{y}}- c z_{5} \,\mathbf{\hat{z}}$ | (4i) | Ga III |
$\mathbf{B_{11}}$ | = | $\frac{1}{2} \, \mathbf{a}_{1}- z_{5} \, \mathbf{a}_{3}$ | = | $\frac{1}{2}a \,\mathbf{\hat{x}}- c z_{5} \,\mathbf{\hat{z}}$ | (4i) | Ga III |