## Abstract We have investigated the convergence of third order correlation energy within the hierarchies of correlation consistent basis sets for helium, neon, and water, and for three stationary points of hydrogen peroxide. This analysis confirms that singlet pair energies converge much slower th
Determination of the order of atoms in a linear molecule
β Scribed by E.Bright Wilson Jr.
- Publisher
- Elsevier Science
- Year
- 1958
- Weight
- 235 KB
- Volume
- 12
- Category
- Article
- ISSN
- 0371-1951
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## Abstract Atomic Fukui indices, which are obtained from the electron density, have been previously shown to be useful in predicting which atoms in a molecule are most likely to suffer nucleophilic, electrophilic, or radicalary attacks. Here, we present a secondβorder generalization of these indic
The formstion of Xa0t'I.l and N32 (A \*XG. B 'II,) it1 sodittttt v.tpottr [= 1Cl14-10'" cm-") irradktted b?\_ 3 IX d?\_e laser tuned IO the 1) lines 11.1s been studied. The density of ewited dtotns ~3s detertnined by ntemtren~entsof the relathe Jbsorption of 3 2P-3 'D transitions. These, together u