441 citations · 5.2k across the 83 of their papers we have counts for
Showing 2023Show all
2 papers · 1 filter
cond-mat.mtrl-sci2023★ 28 cited
Spin-Flop Ordering from Frustrated Ferro- and Antiferromagnetic Interactions: A Combined Theoretical and Experimental Study of a Monolayer
C. Grazioli, Dario Alfè, S. R. Krishnakumar +8
The occurrence of a noncollinear magnetic structure at a Mn monolayer grown epitaxially on Fe(100) is predicted theoretically, using spinor density-functional theory, and observed…
cond-mat.str-el2023★ 2 cited
Intra-atomic Hund's exchange interaction determines spin states and energetics of Li-rich layered sulfides for battery applications
Jae-Hoon Sim, D. D. Sarma, Jean-Marie Tarascon +1
Motivated by experimental suggestions of anionic redox processes helping to design higher energy lithium ion-battery cathode materials, we investigate this effect using first-princ…