CP analysis: TiAl3_AuCu3_CP_I25

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CP Scale:

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Atom Settings:

  Ti Color: (,,)


  Ti Size:


  Al Color: (,,)


  Al Size:



Connection Settings:

Ti-Ti Connection Maximum Length:

Ti-Al Connection Maximum Length:

Al-Al Connection Maximum Length:

Ti-Ti Connection Radius:

Ti-Al Connection Radius:

Al-Al Connection Radius:



Add Polyhedra:

Atom Centered

Polyhedron Radius:

Material Transparency:

Material Color: (,,)

Non Centered

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ScaleBar Settings:

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ScaleBar Size: GPa



Template Settings:



System Name: TiAl3
Number of Unique Sites: 2

Atom type 1
Profile: Ti_25.txt
PSP type: 0
Localized electrons: 0.96

Atom type 2
Profile: Al_25.txt
PSP type: 0
Localized electrons: 0.000000

Hartwigsen-Goedecker-Hutter psp for Ti, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Al, 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: 01-10-2019