New CP Scale:
Current CP Scale:
  Ni Color: (,,)
  Ni Size: Å
  As Color: (,,)
  As Size: Å
Ni-Ni Connection Maximum Length: Å
Ni-As Connection Maximum Length: Å
As-As Connection Maximum Length: Å
Ni-Ni Connection Radius: Å
Ni-As Connection Radius: Å
As-As Connection Radius: Å
Atom Centered
Polyhedron Radius: Å
Material Transparency:
Material Color: (,,)
Non Centered
Material Transparency:
Material Color: (,,)
ScaleBar Postition X-Shift:
ScaleBar Postition Y-Shift:
Show ScaleBar:
ScaleBar Size: GPa
System Name: NiAs2
Number of Unique Sites: 3
Atom type 1
Profile: Ni_25
PSP type: 0
Localized electrons: 3.903
Atom type 2
Profile: As1_25
PSP type: 0
Localized electrons: 0.000000
Atom type 3
Profile: As2_25
PSP type: 0
Localized electrons: 0.0135
Hartwigsen-Goedecker-Hutter psp for Ni, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for As, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Ni, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for As, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for Ni, from PRB58, 3641 (1998)
Hartwigsen-Goedecker-Hutter psp for As, 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: 04-05-2021