7 citations · 14 across the 3 of their papers we have counts for
4 papers
Data driven screening of CaCu-type magnetic structures
Nabaraj Pokhrel, Sheila Whitman, David S. Parker
We develop a machine learning assisted workflow for the rapid screening of permanent magnet candidates within the CaCu structure family. We generated more than 60,000 structure…
Insulating ground state and 2-k magnetic structure of candidate Weyl Hydrogen atom KMn(AsO)
Keith M. Taddei, Kulugammana G. S. Ranmohotti, Duminda S. Liurukara +6
The ideal Weyl 'Hydrogen-atom' semi-metal exhibits only a single pair of Weyl nodes and no other trivial states at the Fermi energy. Such a material would be a panacea in the study…
Ferroelectric Switching Pathways and Domain Structure of SrBi(Ta,Nb)O from First Principles
Nabaraj Pokhrel, Elizabeth A. Nowadnick
Several families of layered perovskite oxide ferroelectrics exhibit a coupling between polarization and structural order parameters, such as octahedral rotation distortions. This c…
Manipulation of spin orientation via ferroelectric switching in Fe-doped Bi2WO6 from first principles
Katherine Inzani, Nabaraj Pokhrel, Nima Leclerc +4
Atomic-scale control of spins by electric fields is highly desirable for future technological applications. Magnetically-doped Aurivillius-phase oxides present one route to achieve…