Superior Performance of Range-Separated Hybrid Functionals...

Superior Performance of Range-Separated Hybrid Functionals for Describing σ* ← σ UV–Vis Signatures of Three-Electron Two-Center Anions

Dupont, Céline, Dumont, Élise, Jacquemin, Denis
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Volume:
116
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp211875r
Date:
March, 2012
File:
PDF, 4.19 MB
english, 2012
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