The quartic force fields of BHs and BeH, have been computed ab initio using an augmented coupled cluster (CCSD(T) ) method and basis sets of spdf and spdfg quality. For BH,, the computed spectroscopic constauts are in very good agreement with recent experimental data, and definitively confirm misass
Accurate ab initio quartic force fields for the N2O and CO2 molecules
โ Scribed by J.M.L. Martin; Peter R. Taylor; Timothy J. Lee
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 700 KB
- Volume
- 205
- Category
- Article
- ISSN
- 0009-2614
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