Vaval, Nayana ; Ghose, Keya ; Nair, Priya ; Pal, Sourav (1994) Stationary coupled cluster response: role of cubic terms in molecular properties Proceedings of the Indian Academy of Sciences - Chemical Sciences, 106 (2). pp. 387-392. ISSN 0253-4134
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Official URL: http://www.ias.ac.in/j_archive/chemsci/106/5/387-3...
Related URL: http://dx.doi.org/10.1007/BF02840758
Abstract
We have demonstrated an application of a stationary coupled cluster response approach for molecular properties using an Euler functional. This involves terms which are of cubic power in cluster amplitudes. We have shown that these are important terms and have also discussed the convergence properties of the functional for higher order properties.
| Item Type: | Article |
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| Source: | Copyright of this article belongs to Indian Academy of Sciences. |
| Keywords: | Stationary Coupled Cluster Response; Euler Functional; Cubic Terms in Molecular Properties |
| ID Code: | 25931 |
| Deposited On: | 04 Dec 2010 10:58 |
| Last Modified: | 17 May 2016 09:19 |
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