𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Small basis sets for calculations of barrier heights, energies of reaction, electron affinities, geometries, and dipole moments

✍ Scribed by Benjamin J. Lynch; Donald G. Truhlar


Book ID
105885640
Publisher
Springer
Year
2004
Tongue
English
Weight
212 KB
Volume
111
Category
Article
ISSN
1432-2234

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


The electronic structure of 2βˆ‘+ boron mo
✍ John R. Ball; Colin Thomson πŸ“‚ Article πŸ“… 1975 πŸ› Elsevier Science 🌐 English βš– 675 KB

The electronic structure cf 'X3+ BS has been investigated by ab-initio SCF crilculations using both GTO and ST0 basis sets. The computed bond length and hyperfine coupling constants are compared uVith experimental data. ## I. Jntroduction Boron monosulphide (BS) is one of the few diatomic radical