Quantum logics and chemical kinetics |
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Authors: | C.I. Ivanov |
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Affiliation: | Bulgarian Academy of Sciences, Institute of Organic Chemistry, Laboratory of Quantum Chemistry, Sofia 1113, Bulgaria |
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Abstract: | ![]() A statistical theory of chemical kinetics is presented based on the quantum logical concept of chemical observables. The apparatus of Boolean algebra is applied for the construction of appropriate composition polynomials referring to any stipulated arrangement of the atomic constituents. A physically motivated probability measure μ(F) is introduced on the field of chemical observables, which considers the occurrence of the yes response of a given F ? . The equations for the time evolution of the species density operators and the master equations for the corresponding number densities are derived. The general treatment is applied to a superposition of elementary substitution reactions (AB)α + C ? (AC)β + B. The expressions for the reaction rate coefficients are established. |
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