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affiliation not provided to SSRN
Plutonium trichloride, Dynamical mean-field theory, Single-particle approximation, Ab initio molecular dynamics
MOFs materials, Degradation, UDMH wastewater, Photocatalysts, Magnetic recovery
N-Doped Graphene, TiO2, Photocatalytic, UDMH, DFT
UDMH, photocatalyst, TiO2, NDMA, DMA
Lithium intercalation, Multiscale modeling, SEI dynamics, Anode materials, Concentration polarization
Electronic correlations, f electron dynamics, +DMFT approach, orbit coupling (SOC), Kondo quasiparticle resonances
transition metal dichalcogenides, d-orbital hybridization, Radiation-hardened elasticity, Neutron irradiation