112 citations · 446 across the 15 of their papers we have counts for
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Reduction of Magnetic Interaction Due to Clustering in Doped Transition-Metal Dichalcogenides: A Case Study of Mn, V, Fe-Doped
Sabyasachi Tiwari, Maarten Van de Put, Bart Soree +2
Using Hubbard U corrected density functional theory calculations, lattice Monte-Carlo, and spin-Monte-Carlo simulations, we investigate the impact of dopant clustering on the magne…
Transition-Metal Nitride Halide Dielectrics for Transition-Metal Dichalcogenide Transistors
Mehrdad Rostami Osanloo, Ali Saadat, Maarten L. Van de Put +2
Using first-principles calculations, we investigate six transition-metal nitride halides (TMNHs): HfNBr, HfNCl, TiNBr, TiNCl, ZrNBr, and ZrNCl as potential van der Waals (vdW) diel…
Computing Curie temperature of two-dimensional ferromagnets in the presence of exchange anisotropy
Sabyasachi Tiwari, Joren Vanherck, Maarten L. Van de Put +2
We compare three first-principles methods of calculating the Curie temperature in two-dimensional (2D) ferromagnetic materials (FM), modeled using the Heisenberg model, and propose…