𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Ab initio SCF calculations of the boron cage molecules B9H9 and B9Cl9

✍ Scribed by David J. Swanton; Reinhart Ahlrichs; Marco Häser


Book ID
107733456
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
349 KB
Volume
155
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Ab initio SCF MO results for the carbora
✍ Benjamin M. Gimarc; Baiching Dai; Jane J. Ott 📂 Article 📅 1989 🏛 John Wiley and Sons 🌐 English ⚖ 246 KB

We report the geometry-optimized total energies and bond distances for the closo-carborane isomers 3,5-CzB6H8, 1,7-CzB7Hs, and 1,2-CzB7Hs calculated by the ab initio SCF MO method using the STO-3G basis set. Relative energies are compared with those of the other carborane isomers in the 8-and 9atom