7 citations · 7 across the 3 of their papers we have counts for
5 papers
First-principles study of exchange coupling constants in NdFe amorphous alloy
Asako Terasawa, Yoshihiro Gohda
We investigate the exchange coupling constant in NdFe amorphous alloys with different compositions within the framework of first-principles calculation. We obs…
Single-site orthogonalization for first-principles computations of exchange coupling constants
Asako Terasawa, Sonju Kou, Taisuke Ozaki +1
For accurate first-principles computations of exchange coupling constants by the Liechtenstein method with localized basis sets, we developed a scheme using the single-sit…
Efficient algorithm based on Liechtenstein method for computing exchange coupling constants using localized basis set
Asako Terasawa, Munehisa Matsumoto, Taisuke Ozaki +1
For large-scale computation of the exchange coupling constants , we reconstruct the Liechtenstein formula for localized orbital representation and simplify the energy integ…
Hidden orders in amorphous structures: extraction of nearest neighbor networks of amorphous Nd-Fe alloys with Gabriel graph analyses
Asako Terasawa, Yoshihiro Gohda
Using the scheme of Delaunay and Gabriel graphs, we analyzed the amorphous structures of computationally created Nd-Fe alloys for several composition ratios based on melt quench si…
An ignition key for atomic-scale engines
Daniel Dundas, Brian Cunningham, Claire Buchanan +3
A current-carrying resonant nanoscale device, simulated by non-adiabatic molecular dynamics, exhibits sharp activation of non-conservative current-induced forces with bias. The res…