V. N. Jafarova

2 Questions 3 Answers 0 Followers

Questions related from V. N. Jafarova

How can QuantumATK be used to calculate spin-glass state (disorder local moment)?

Hello! I want to calculate SG state for TM-doped semiconductor compound using Atomistic Tool Kit code. How to calculate? Ho to chose the parameter (collinear or non collinear? Random? ) How to...

01 January 1970 1,788 0 View

How to convert to Rydberg? Kmax=7/RMT

For wave function in the interstitial region the plane wave cut-off value of Kmax=7/RMT was taken and fine k mesh of 2000 was used in the Brillouin zone integration and convergence was checked...

01 January 1970 2,801 0 View