## Abstract The lowestβenergy structures and electronic properties of the BLi__~n~__ (__n__ = 1β7) clusters are reported using the B3LYP, MP2, and CCSD(T) methods with the augβccβpVDZ basis set. Though the results at the B3LYP level agree well with those at the CCSD(T) level, the MP2 method is rath
β¦ LIBER β¦
Thermochromic and Spectral Properties of Perimidinespirocyclohexadienones: A DFT and ab initio Studies
β Scribed by Dorogan, I. V.; Minkin, V. I.
- Book ID
- 121430511
- Publisher
- Taylor and Francis Group
- Year
- 2005
- Tongue
- English
- Weight
- 125 KB
- Volume
- 431
- Category
- Article
- ISSN
- 1542-1406
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