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Complete basis set and Gaussian ab initio study of protonated isomers of borohydride anion

โœ Scribed by B.S Jursic


Book ID
114143665
Publisher
Elsevier Science
Year
1999
Tongue
English
Weight
85 KB
Volume
492
Category
Article
ISSN
0166-1280

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Complete basis set and Gaussian-2 ab ini
โœ Branko S. Jursic ๐Ÿ“‚ Article ๐Ÿ“… 1998 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 159 KB

Energies for highly symmetric cyclic hydrogen clusters H with D n nh ลฝ . ลฝ . symmetry were evaluated with Gaussian-2 G2 and quadratic complete basis set CBSQ ab initio approaches. The energies were compared with linear hydrogen clusters as well as with their energies of formation from hydrogen and c