148 citations · 608 across the 17 of their papers we have counts for
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Absolute Reference Energy to Realign the Band-edges of Inorganic Semiconductors Using First-principles Calculations
Tilak Das, Xavier Rocquefelte, Stèphane Jobic
The challenge of finding an absolute reference energy from first-principles simulations to realigning semiconductor's valence band-top and conduction band-bottom, a theoretical met…
Competition between static and dynamic magnetism in the Kitaev spin liquid material Cu2IrO3
Eric M. Kenney, Carlo U. Segre, William Lafargue-Dit-Hauret +13
Anyonic excitations emerging from a Kitaev spin liquid can form a basis for quantum computers. Searching for such excitations motivated intense research on the honeycomb iridate ma…
Site-Specific Spin Reorientation in Antiferromagnetic State of Quantum System SeCuO
Nikolina Novosel, William Lafargue-Dit-Hauret, Željko Rapljenović +5
We report on the magnetocrystalline anisotropy energy (MAE) and spin reorientation in antiferromagnetic state of spin tetramer system SeCuO observed in torque magnetome…