Encyclopedia of Crystallographic Prototypes

AFLOW Prototype: A_cP1_221_a-001

This structure originally had the label A_cP1_221_a. Calls to that address will be redirected here.

If you are using this page, please cite:
M. J. Mehl, D. Hicks, C. Toher, O. Levy, R. M. Hanson, G. L. W. Hart, and S. Curtarolo, The AFLOW Library of Crystallographic Prototypes: Part 1, Comp. Mat. Sci. 136, S1-S828 (2017). (doi=10.1016/j.commatsci.2017.01.017)

Links to this page

https://aflow.org/p/NG7Y
or https://aflow.org/p/A_cP1_221_a-001
or PDF Version

α-Po ($A_{h}$, simple cubic) Structure: A_cP1_221_a-001

Picture of Structure; Click for Big Picture
Prototype Po
AFLOW prototype label A_cP1_221_a-001
Strukturbericht designation $A_{h}$
ICSD 655031
Pearson symbol cP1
Space group number 221
Space group symbol $Pm\overline{3}m$
AFLOW prototype command aflow --proto=A_cP1_221_a-001
--params=$a$

  • This is a simple cubic lattice. Polonium is the only element known with this ground state. Originally, Po was assigned Strukturbericht designation $A19$, which is now considered to be incorrect. (Donohue, 1982, 390)

\[ \begin{array}{ccc} \mathbf{a_{1}}&=&a \,\mathbf{\hat{x}}\\\mathbf{a_{2}}&=&a \,\mathbf{\hat{y}}\\\mathbf{a_{3}}&=&a \,\mathbf{\hat{z}} \end{array}\]

Basis vectors

Lattice coordinates Cartesian coordinates Wyckoff position Atom type
$\mathbf{B_{1}}$ = $0$ = $0$ (1a) Po I

References

  • W. H. Beamer and C. R. Maxwel, The Crystal Structure of Polonium, J. Chem. Phys. 14, 569 (1946), doi:10.1063/1.1724201.
  • C. Gottfried, ed., Strukturbericht Band IV 1936 (Akademische Verlagsgesellschaft M. B. H., Leipzig, 1938).

Found in

  • J. Donohue, The Structures of the Elements (Robert E. Krieger Publishing Company, New York, 1974).

Prototype Generator

aflow --proto=A_cP1_221_a --params=$a$

Species:

Running:

Output: