Visualitzant per autor "Piris, Mario"
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Performance of PNOF5 Natural Orbital Functional for Radical Formation Reactions: Hydrogen Atom Abstraction and C–C and O–O Homolytic Bond Cleavage in Selected Molecule

Two new constraints for the cumulant matrix

On the performance of natural orbital functional approximations in the Hubbard model

Phase dilemma in natural orbital functional theory from the N-representability perspective