Geometry

Info

ID:

1

ICSD:

36456

Name:

Silver chromium phosphorus sulfide (0.5/0.5/1/3)

Comp.:

Ag0.5Cr0.5P1S3

Symm.:

P12/a1(13)

Latt.:

monoclinic

Spin:

5.505

Eg/Eg':

1.485/1.459 eV

me/mh:

-73.882/-112.442

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