General linear correction method for DFT+X energy: application to U-M (M=Al, Ga, In) alloys under high pressure

X. L. Pan, H. X. Song, Y. Sun +6

DFT+X methods, such as DFT+U and DFT+DMFT, are important supplements to standard density functional theory when strong on-site Coulomb interactions are present. However, the involv…