Showing posts with the label Magnetic CalculationsShow All
Magnetic Calculations
How to calculate the magnetic exchange parameter of Nickel Oxide NiO
We will calculate the J2 parameter which represents the superexchange coupling between the next nearest neighbors (d Ni-Ni = 4.17 A)using the GGA+U …
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Magnetic Calculations
How to do a DOS calculation for collinear and non collinear magnetic structures
We take the example of Nickel Collinear calculation POSCAR fcc: -10.93 0.5 0.5 0.0 0.0 0.5 0.5 0.5 0.0 0.5 …
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My name is Dr Abderrahmane Reggad. I'm a 54 year old and I am a researcher in materials' sciences.
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