Geometry

Info

ID:

7911

ICSD:

100172

Name:

Potassium copper phosphate(V) - LT

Comp.:

Cu1K1O4P1

Symm.:

P1211(4)

Latt.:

monoclinic

Spin:

0.010

Eg/Eg':

0.556/0.551 eV

me/mh:

174.270/-21.386

K-data

high symmetry path:

G - Z - C - Y - G - B - D - E0 - A0 - Y

high symmetry points:

G: 0.0 0.0 0.0 C: 0.5 0.5 0.0 B: 0.0 0.0 0.5 D: 0.0 0.5 0.5 A0: 0.5 0.0 0.5 Y: 0.5 0.0 0.0 Z: 0.0 0.5 0.0 E0: 0.5 0.5 0.5

DOS

Bands