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Electron diffraction study of the structure of LiBO2and NaBO2metaborate molecules in the vapor state

✍ Scribed by P. A. Akishin; V. P. Spiridonov


Publisher
SP MAIK Nauka/Interperiodica
Year
1962
Tongue
English
Weight
197 KB
Volume
3
Category
Article
ISSN
0022-4766

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The electron affinity of LiBO2 and the s
✍ Alexander I. Boldyrev; Paul von R. Schleyer πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 549 KB

The geometries and fundamental frequencies of the LiBOF anion and the LiB02 molecule were calculated ab initio at MP2/6-3 I+ G\*. Linear forms have the lowest energy in both cases. The calculated electron affinity (EA ) of LiBOz is nearly the same when usingKoopmans'theorem,aswel1astheAPWHFandAPMP2,