Quantum-Chemical Calculation of Reactive Fuels as H-Acids
Titel:
Quantum-Chemical Calculation of Reactive Fuels as H-Acids
Auteur:
Babkin, V. A. Fedunov, R. G. Ponomarev, O. A. Sangalov, Yu. A. Sangalov, E. Yu. Minsker, K. S. Minsker, S. K. Zaikov, G. E.
Verschenen in:
International journal of polymeric materials
Paginering:
Jaargang 46 (2000) nr. 1-2 pagina's 131-139
Jaar:
2000-06-01
Inhoud:
The theoretical evaluation of acid strength reactive fuels, through quantum-chemical calculation by the method CNDO/2 of the charges on hydrogen atoms, which correlate with the universal index of acidity is presented. Correlations defining relationship of some parameters of combustion with the accounting parameters of acidic strength of the fuels are established to oxygen.