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Crystal Cohesion and Conformational Energies pp 80–107Cite as

Cohesion and Ionicity in Organic Semiconductors and Metals

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Part of the book series: Topics in Current Physics ((TCPHY,volume 26))

Abstract

The cohesive energy calculations for organic ionic crystals use quantum-chemical atom-in-molecule partial charges, dipole moments and polarizabilities, and classical lattice sums. These calculations can be connected with Löwdin’s formal, fully quantum-mechanical theory and with the relevant Born-Haber cycles.

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Additional Reference with Title

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  1. R. M. Metzger
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  1. Dept. of Chemistry, University of Mississippi, University, MS, 38677, USA

    Robert M. Metzger Ph.D.

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Metzger, R.M. (1981). Cohesion and Ionicity in Organic Semiconductors and Metals. In: Metzger, R.M. (eds) Crystal Cohesion and Conformational Energies. Topics in Current Physics, vol 26. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-81577-5_4

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  • DOI: https://doi.org/10.1007/978-3-642-81577-5_4

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