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20182026
most citedTheoretical insights into the topology of molecular excitons from single-reference excited states calculation methods

9 citations · 25 across the 9 of their papers we have counts for

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physics.chem-ph2019★ 2 cited

Diagnosis of two evaluation paths to density-based descriptors of molecular electronic transitions

Gabriel Breuil, Kaltrina Shehu, Elise Lognon +3

In this paper we discuss the reliability of two computational methods (numerical integration on Cartesian grids, and population analysis) used for evaluating scalar quantities rela…