By Richard F. W. Bader
The molecular constitution hypothesis--that a molecule is a set of atoms associated by way of a community of bonds-- offers the imperative technique of ordering and classifying observations in chemistry. even if this speculation isn't really similar on to the physics which governs the motions of atomic nuclei and electrons. it's the function of this significant new booklet to teach idea might be constructed to set up the molecular constitution speculation, demonstrating that the atoms in a molecule are genuine, with houses expected and outlined by way of the legislation of quantum mechanics, and that the constitution their presence imparts to a molecule is certainly a end result of the underlying physics. for this reason, the class established upon the concept that of atoms in molecules is free of its empirical constraints and the entire predictive energy of quantum mechanics could be integrated into the ensuing theory--a conception of atoms in molecules. Eminently available and readable, the publication will curiosity all scientists concerned with scan and statement on the atomic point, as well as theoreticians.
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Extra info for Atoms in Molecules: A Quantum Theory
J. C. Light, Disc. , 44, 14 (1967). 9. (a) J. C. Polanyi and S. D. Rosner, J. Chem. Phys. 38, 1028 (1963); (b) P. J. Kuntz, E. M. Nerneth, J. C. Polanyi, S. D. Rosner, and C. E. Young, J. Chem. Phys. 44, 1168 (1966); (c) K. G. Anlauf, J. C. Polanyi, W. H. Wong, and K. B. Woodall, J. Chem. Phys. 49, 5189 (1968); (d) P. J. Kuntz, E. M. Nemeth, and J. C. Polanyi, J. Chem. Phys. 50, 4607 (1969); (e) P. J. Kuntz, M. H. Mok, and J. C. Polanyi, J . Chem. Phys. 50,4623 (1969). 10. (a) N. C. Blais and D.
The energy of these reactions must be disposed of as kinetic energy in the products because there are no accessible internal energy states available in the neutral helium or H + products, and H atoms do not appear to be a suitable energy sink for the amount of energy that has to be dissipated. The conversion of internal to kinetic energy was shown again to be a process requiring very small impact parameter collisions. The single source work on low energy elemental ion reactions which gave experimental results in very good agreement with G-S theory was not initially accepted without reservation because of difficulties encountered by many workers in their attempts to carry out single source experiments.
A) M. Karplus, R. N. Porter, and R. D. Sharma, J. Chem. Phys. 40, 2033 (1964); 43, 3259 (1965); (b) M. Godfrey and M. Karplus, J . Chem. Phys. 49, 3602 (1968). 12. M. G. Evans and M. Polanyi, Trans. 35, 178 (1939). QUANTUM THEORIES OF CHEMICAL KINETICS 31 13. D. J. Kouri, J. Chem. Phys. 51, 5204 (1969). 14. W. N. Sams and D. J. Kouri, J. Chem. Phys. 51,4809 (1969). 15. D. Micha, Arkiv. For Fysik 30, 425 (1965). 16. M. Karplus and K. T. Faraday Soc. 44, 56 (1967). 17. H. Hulbert and J . Hirschfelder, J .