2 papers
cond-mat.mtrl-sci2025
The chemisorption thermodynamics of O and HO on AFM UO surfaces unraveled by DFT+U-D3 study
Yang Huang, Le Zhang, Hefei Ji +5
Unraveling the adsorption mechanism and thermodynamics of O and HO on uranium dioxide surfaces is critical for the nuclear fuel storage and uranium corrosion. Based on the…
cond-mat.str-el2024
Mechanism of magnetic phase transition in correlated magnetic metal: insight into itinerant ferromagnet FeGeTe
Yuanji Xu, Yuechao Wang, Xintao Jin +4
Developing a comprehensive magnetic theory for correlated itinerant magnets poses challenges due to the difficulty in reconciling both local moments and itinerant electrons. In thi…