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Revitalizing the concept of bond order through delocalization measures in real space
Ab initio quantum chemistry is an independent source of information supplying an ever widening group of experimental chemists. However, bridging the gap between these ab initio data and chemical insight remains a challenge. In particular, there is a need for a bond order index that characterizes nov...
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| Veröffentlicht in: | Chem Sci |
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| Hauptverfasser: | , , , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
Royal Society of Chemistry
2018
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6049528/ https://ncbi.nlm.nih.gov/pubmed/30061983 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c8sc01338a |
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