Sen, K. D. (1991) Electronegativities, hardness and their variation with nuclear charge in atoms Chemical Physics Letters, 184 (4). pp. 318-320. ISSN 0009-2614
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Official URL: http://www.sciencedirect.com/science/article/pii/0...
Related URL: http://dx.doi.org/10.1016/0009-2614(91)85130-O
Abstract
The calculations of electronegativity, absolute hardness, and their variation with nuclear charge, Z, have been carried out for atoms using the local-spin-density functional with correlation energy. It is shown that excellent values of Z-variation can be obtained in terms of the variation with the total number of electrons in the radical expectation value < 1/r > which defines the electrostatic potential at the nucleus.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to Elsevier Science. |
| ID Code: | 45078 |
| Deposited On: | 24 Jun 2011 13:45 |
| Last Modified: | 24 Jun 2011 13:45 |
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