Geometry

Info

ID:	1815
ICSD:	427443
Name:	Calcium iron arsenide (1/5/3)
Comp.:	As3Ca1Fe5
Symm.:	P121/m1(11)
Latt.:	monoclinic
Spin:	15.326
E_g/E_g':	None/None eV
m_e/m_h:	None/None

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