no code implementations • 15 Jul 2020 • Sangmoon Yoon, Kyoungsuk Jin, Sangmin Lee, Ki Tae Nam, MiYoung Kim, Young-Kyun Kwon
We investigated the effects of paramagnetic (PM) fluctuations on the thermochemistry of the MnO(100) surface in the oxygen evolution reaction (OER) using the "noncollinear magnetic sampling method \textit{plus} $U$" (NCMSM$+U$).
Materials Science Mesoscale and Nanoscale Physics
