Chem. Sci., 2025, Accepted Manuscript
DOI: 10.1039/D5SC00627A, Edge Article
Open Access Open Access
Creative Commons Licence&nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Rinat T. Nasibullin, Maria Dimitrova, Rashid Valiev, Dage Sundholm
We have developed a method to calculate orbital contributions to magnetically induced current density (MICD) susceptibilities in molecules using gauge-including atomic orbitals (GIAO). The methods implemented in the GIMIC program…
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