Perturbation calculations of the interaction energies between non-bonded hydrogen atoms. Part 2
نویسندگان
چکیده
منابع مشابه
Perturbation Calculations of the Interaction Energies between Non-Bonded Hydrogen Atoms
In the previous paper 1 (hereafter referred to as I) the non-bonded interaction energies between the rigid fragments AH and BH were examined in some detail. Particular attention was given to the analysis of the various contributions to the interaction eneregy in the region of large non-bonded overlap.f In those calculations the position of the fragments with respect to one another was varied, k...
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ژورنال
عنوان ژورنال: Transactions of the Faraday Society
سال: 1971
ISSN: 0014-7672
DOI: 10.1039/tf9716702819