An ab initio study on the structure, energetics and spectra of F(CO2)n-: the observation on the strong F-CO2 bond
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Date
2021
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ab initio electronic structure method, structures, energetics, and photoelectron spectral property, strong F-CO2 bond, microscopic theory-based expression, vertical detachment energy (VDE), solvation energy (SE) values
Source
New Journal of Chemistry, 2021. Vol. 45: pp. 6872- 6879