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The infra-red spectra and structures of Li2CO3 and anhydrous Na3CO3

โœ Scribed by K Buijs; C.J.H Schutte


Publisher
Elsevier Science
Year
1961
Weight
331 KB
Volume
17
Category
Article
ISSN
0371-1951

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The geometricsand stabiliticsof the Li-CO2 and Na--CO? tomplcxes arc calculated using the self-consistent-field Hartree-Fock method. The minimum energy, Czv strutures of G-CO2 ;Ind Nil-CO2 are found to bc stnblc, by 0.85 and 0.34 cV, respectively, with rcspcct to dissociation to CO2 + alkali atom.