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• W1492293529 endingPage "102" @default.
• W1492293529 startingPage "65" @default.
• W1492293529 abstract "The word “polymer” embraces a large class of complex and diverse compounds among which the quantum theory at present considers only a rather restricted subset. The range of applications of this quantum theory is not at all restricted to such unusual materials. The main limitation comes obviously from the ability of the model to comprise the physics and chemistry of what is actually a “regular” polymer. For all these materials, and in the same way as for simpler molecules, quantum chemistry is now starting to provide powerful instruments for interpreting and predicting the physical and chemical properties (structure, bonding, reactivity, etc.) for which a rather detailed knowledge of the electronic structure is required. Another reason for developing quantum methods for polymers is the increasing use of refined techniques (XPS, IR, NMR, etc.) to solve fundamental polymer problems—for example,XPS (or ESCA-electron spectroscopy for chemical analysis) spectra obtained with monochromatic X-ray radiation turn out to be powerful tools with which to study the electronic structure of polymers, both by providing precise information on core level binding energies and line shapes and by allowing the recording of the distribution of the valence electronic levels that might constitute a real and unique “fingerprint” of the polymer. The main conclusion of this chapter is that quantum mechanical methods are now able to provide significant understanding and insight into the electronic properties of regular polymers." @default.
• W1492293529 created "2016-06-24" @default.
• W1492293529 creator A5025970115 @default.
• W1492293529 date "1980-01-01" @default.
• W1492293529 modified "2023-10-18" @default.
• W1492293529 title "Quantum Mechanical Methods for Regular Polymers" @default.
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• W1492293529 doi "https://doi.org/10.1016/s0065-3276(08)60314-7" @default.
• W1492293529 hasPublicationYear "1980" @default.
• W1492293529 type Work @default.

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