Browsing by Keywords "Ab-initio calculation"

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Electronic and elastic properties of the multiferroic crystals with the Kagome type lattices -Mn3V2O8 and Ni3V2O8: First principle calculations

Koç, H.; Palaz, S.; Mamedov, Amirullah M.; Özbay, Ekmel (Taylor & Francis, 2019-08-16)

The electronic, mechanical, and optical properties of the Kagome staircase compounds, Mn3V2O8 and Ni3V2O8, have been investigated using the VASP (Vienna ab-initio Simulation Program) that was developed within the density ...