| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5383795 | Chemical Physics Letters | 2011 | 6 Pages |
Abstract
⺠A binding energy for corannulene dimer was calculated at QCISD(T)/aug-cc-pVTZ level. ⺠Dispersion-corrected DFT functionals were tested using the benchmark results. ⺠Several structural motifs of the dimer were studied at B97-D/cc-pVQZ level. ⺠Efficiency of the dispersion attraction of curved carbon networks was assessed.
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Authors
Tomasz Janowski, Peter Pulay, A.A. Sasith Karunarathna, Andrzej Sygula, Svein Saebø,