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Comparative Study of Weak Interactions in Molecular Crystals: H−H Bonds vs Hydrogen Bonds †

✍ Scribed by Wolstenholme, David J.; Cameron, T. Stanley

Book ID
121386854
Publisher
American Chemical Society
Year
2006
Tongue
English
Weight
221 KB
Volume
110
Category
Article
ISSN
1089-5639

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📜 SIMILAR VOLUMES

Molecular orbital studies of hydrogen bo
Molecular orbital studies of hydrogen bonds. IV. Hydrogen bonds in excited states of H2CO with H2O
✍ Suehiro Iwata; Keiji Morokuma 📂 Article 📅 1973 🏛 Elsevier Science 🌐 English ⚖ 415 KB

Ab initio calculations for the interacting system of lower excited states of planar and bent HzCO with B?O have been carried out with a minimum basis set, using the recently proposed electron-hole potential method The blue shifts of the n-z\* transition are evaiuated as I100 and 142Q cm-\* ' .or th