Gadre, Shridhar R. ; Sears, Stephen B. (1979) An application of information theory to Compton profiles The Journal of Chemical Physics, 71 (11). pp. 4321-4323. ISSN 0021-9606
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Official URL: http://jcp.aip.org/resource/1/jcpsa6/v71/i11/p4321...
Related URL: http://dx.doi.org/10.1063/1.438269
Abstract
The information theoretic technique of entropy maximization has been applied to Compton profile (CP) data, employing single distribution moments <p≳ and<p2≳ (average momentum and energy respectively) as constraints. Two relations between various CP parameters, viz., J (0) <p≳=N2 and J2(0) II E II =3N3/4pπ , have thereby been obtained. The momentum constraint predicts J (0) and the half-width, q0.5, of the profiles quite well. A comparison of these results to some earlier empirically established correlations between J (0), q0.5, and molecular energy has been made.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to American Institute of Physics. |
| Keywords: | Compton Effect; Information Theory; Correlations; Molecular Models; Entropy |
| ID Code: | 86903 |
| Deposited On: | 14 Mar 2012 07:47 |
| Last Modified: | 14 Mar 2012 07:47 |
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