## Abstract The ability to use calculated OH frequencies to assign experimentally observed peaks in hydrogen bonded systems hinges on the accuracy of the calculation. Here we test the ability of several commonly employed model chemistries—HF, MP2, and several density functionals paired with the 6‐3
Bifurcated CH2⋅⋅⋅O and (CH)2⋅⋅⋅FC Weak Hydrogen Bonds: The Oxirane–Difluoromethane Complex
✍ Scribed by Susana Blanco; Juan C. López; Alberto Lesarri; Walther Caminati; José L. Alonso
- Publisher
- John Wiley and Sons
- Year
- 2004
- Tongue
- English
- Weight
- 137 KB
- Volume
- 5
- Category
- Article
- ISSN
- 1439-4235
No coin nor oath required. For personal study only.
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