## Abstract __Ab initio__ complete optimizations at MP2/6‐31++G\*\* level have been performed in the T‐shaped geometry of the benzene–benzene and benzene–naphthalene complexes. To check the effect of the basis set superposition error (BSSE), optimizations have been done in the BSSE corrected and BS
✦ LIBER ✦
The change of the proton magnetic shielding in red- and blue-shifted linear hydrogen-bonded complexes
✍ Scribed by Sean A. C. McDowell; A. David Buckingham
- Publisher
- Springer
- Year
- 2006
- Tongue
- English
- Weight
- 122 KB
- Volume
- 119
- Category
- Article
- ISSN
- 1432-2234
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