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20242026
most citedChemical Evolution of R-process Elements in Stars (CERES): IV. An observational run-up of the third r-process peak with Hf, Os, Ir, and Pt

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physics.chem-ph2025

Configuration-interaction calculations with density-functional theory molecular orbitals for modeling valence- and core-excited states in molecules

Giorgio Visentin, Francois Mauger

We investigate configuration-interaction (CI) calculations on a basis of molecular orbitals generated by preliminary density-functional theory (DFT) calculations. We use this CI/DF…