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http://dspace.bits-pilani.ac.in:8080/jspui/xmlui/handle/123456789/2763| Title: | Correlation of Polarizability, Hardness, and Electronegativity: Polyatomic Molecules |
| Authors: | Roy, Ram Kinkar |
| Keywords: | Chemistry Polarizability Hardness Electronegativity Polyatomic Molecules |
| Issue Date: | 1994 |
| Publisher: | ACS |
| Abstract: | In this paper, for the first time we have correlated the hardness (η), softness (s), and polarizability (P) with the electronegativity and the distortion (ΔR) of a single bond in a complex polyatomic system. The study also shows some interesting: trends as different types of bonds are distorted. We have suggested a new concept, "local bond hardness", in a complex polyatomic system. The molecules H2O, CH4, CH3Cl, and CH3F are chosen as primary test cases. |
| URI: | https://pubs.acs.org/doi/10.1021/j100092a011 http://dspace.bits-pilani.ac.in:8080/xmlui/handle/123456789/2763 |
| Appears in Collections: | Department of Chemistry |
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