339 citations · 947 across the 22 of their papers we have counts for
3 papers · 1 filter
Transferable Potential Function for Flexible HO Molecules Based on the Single Center Multipole Expansion
Elvar Örn Jónsson, Soroush Rasti, Marta Galynska +2
A potential function is presented for describing a system of flexible HO molecules based on the single center multipole expansion (SCME) of the electrostatic interaction. The m…
Surface sites drive Fe enrichment at reactive olivine interfaces
Ming Geng, Kunfeng Qiu, Jun Deng +1
Calculations based on density functional theory and statistical mechanics reveal how Fe site preference in olivine is altered at interfaces. Although the M1 site is favoured in bul…
Skyrmions in antiferromagnets: thermal stability and the effect of external field and impurities
Maria N. Potkina, Igor S. Lobanov, Hannes Jónsson +1
Calculations of skyrmions in antiferromagnets (AFMs) are presented, and their properties compared with skyrmions in corresponding ferromagnets (FMs). The rates of skyrmion collapse…