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DFT, CBS-Q, W1BD and G4MP2 calculation of the proton and electron affinities, gas phase basicities and ionization energies of saturated and unsaturated carboxylic acids (C1-C4)

“DFT, CBS-Q, W1BD and G4MP2 calculation of the proton and electron affinities, gas phase basicities and ionization energies of saturated and unsaturated carboxylic acids (C1-C4)"

       Y. Valadbeigi, H. Farrokhpour, Int. J. Quant. Chem (Accepted 2013).

Publications
Month/Season: 
January
Year: 
2013