313 citations · 2.8k across the 88 of their papers we have counts for
7 papers · 1 filter
Carbon-Rich Carbon Nitride Monolayers with Dirac Cones: Dumbbell C4N
Linyang Li, Xiangru Kong, Ortwin Leenaerts +3
Two-dimensional (2D) carbon nitride materials play an important role in energy-harvesting, energy-storage and environmental applications. Recently, a new carbon nitride, 2D polyani…
Magnetism and ultra-fast magnetization dynamics of Co and CoMn alloys at finite temperature
R. Chimata, E. K. Delczeg-Czirjak, A. Szilva +9
Temperature-dependent magnetic experiments like pump-probe measurements generated by a pulsed laser have become a crucial technique for switching the magnetization in the picosecon…
Exchange interactions of CaMnO3 in the bulk and at the surface
Samara Keshavarz, Yaroslav Kvashnin, Debora Rodrigues +7
In this work, we present electronic and magnetic properties of CaMnO3 (CMO) as obtained from ab initio calculations. We identify the preferable magnetic order by means of density f…
Structural, electronic and magnetic properties of Fe doped CoCrO: insights from ab initio calculations
Debashish Das, Shreemoyee Ganguly, Biplab Sanyal +1
CoCrO has attracted significant attention recently due to several interesting properties such as magnetostriction, magnetoelectricity etc.. More recent experiments on Fe su…
Magnetism and exchange interaction of small rare-earth clusters; Tb as a representative
Lars Peters, Saurabh Ghosh, Biplab Sanyal +9
Here we follow, both experimentally and theoretically, the development of magnetism in Tb clusters from the atomic limit, adding one atom at a time. The exchange interaction is, su…
The valence and spectral properties of rare-earth clusters
L. Peters, I. Di Marco, M. S. Litsarev +5
The rare-earths are known to have intriguing changes of the valence, depending on chemical surrounding or geometry. Here we make predictions from theory that combines density funct…