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A Spectroscopic Validation of the Improved Lennard–Jones Model
The Lennard–Jones (LJ) and Improved Lennard–Jones (ILJ) potential models have been deeply tested on the most accurate CCSD(T)/CBS electronic energies calculated for some weakly bound prototype systems. These results are important to plan the correct application of such models to systems at increasin...
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| Veröffentlicht in: | Molecules |
|---|---|
| Hauptverfasser: | , , , , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
MDPI
2021
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8271504/ https://ncbi.nlm.nih.gov/pubmed/34206733 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26133906 |
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