2 papers
cond-mat.mtrl-sci2021
Importance of anisotropic Coulomb interactions in the electronic and magnetic properties of MnO
Sangmoon Yoon, Sangmin Lee, Subeen Pang +2
We report the importance of anisotropic Coulomb interactions in DFT+U calculations of the electronic and magnetic properties of MnO. The effects of anisotropic interactions…
cond-mat.str-el2018
Noncollinear magnetic sampling method for paramagnetic Mott insulator MnO
Sangmoon Yoon, Seoung-Hun Kang, Sangmin Lee +4
We present a new approach based on the static density functional theory (DFT) to describe paramagentic MnO, which is a representative paramagnetic Mott insulator. We appended the s…