CuAl2

CP Scale:

New CP Scale:

Current CP Scale:

Atom Settings:

Al Color: (,,)

Al Size: Å

Cu Color: (,,)

Cu Size: Å

Connection Settings:

Al-Al Connection Maximum Length: Å

Al-Cu Connection Maximum Length: Å

Cu-Cu Connection Maximum Length: Å

Al-Al Connection Radius: Å

Al-Cu Connection Radius: Å

Cu-Cu Connection Radius: Å

Add Polyhedra:

Atom Centered

Polyhedron Radius: Å

Material Transparency:

Material Color: (,,)

Non Centered

Material Transparency:

Material Color: (,,)

ScaleBar Settings:

ScaleBar Postition X-Shift:

ScaleBar Postition Y-Shift:

Show ScaleBar:

ScaleBar Size: GPa

Template Settings:

System Name: CuAl2
Number of Unique Sites: 2

Atom type 1
Profile: Al_75.txt
PSP type: 0
Localized electrons: 0.000000

Atom type 2
Profile: Cu_75.txt
PSP type: 1
Localized electrons: 5.6085

Hartwigsen-Goedecker-Hutter psp for Al, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Cu, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Al, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Cu, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Al, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Cu, from PRB58, 3641 (1998)
Version 7.10.5 of ABINIT
DFT Method: Local Density Approximation

CP Scheme Contributor: kkamp, UW-Madison
Calculation was completed on: 07-08-2018