Relativistic Orbital-Optimized Density Functional Theory for Accurate Core-Level Spectroscopy | The Journal of Physical Chemistry Letters
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Regulating Cu atom orbital state on self-built photogate catalyst for improving HCOOH selectivity of CO2 reduction - ScienceDirect
Conservation laws, radiative decay rates and excited state localization in organometallic complexes with strong spin-orbit coupling | Scientific Reports
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Orbital-specific mapping of the ligand exchange dynamics of Fe(CO)5 in solution | Nature
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