MRD-CI calculations have been carried out for hydrogen-bonded complexes involving formaldehyde and a series of proton donors of varying strengths: N&OH, NH=CHOH, CHr=CHOH and HsO. The energies for the singlet and triplet n-+x\* states of the various complexes are calculated and the shift in the tran
β¦ LIBER β¦
A computational study of the bent hydrogen bond in the formaldehyde-hydrogen chloride complex
β Scribed by H.Chuan Kang
- Book ID
- 114142203
- Publisher
- Elsevier Science
- Year
- 1997
- Tongue
- English
- Weight
- 505 KB
- Volume
- 401
- Category
- Article
- ISSN
- 0166-1280
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