Summary
In this paper we report calculation of the nuclear magnetic shielding constant using extended coupled cluster response approach. We present the results for the HF, BH, CO and N2 molecules. These results show importance of correlation corrections for the shielding constant.
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Ravichandran, L., Joshi, S., Vaval, N. (2010). Chemical shielding of closed-shell molecules using Extended Coupled-cluster theory. In: Chaudhuri, R., Mekkaden, M., Raveendran, A., Satya Narayanan, A. (eds) Recent Advances in Spectroscopy. Astrophysics and Space Science Proceedings. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-10322-3_12
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DOI: https://doi.org/10.1007/978-3-642-10322-3_12
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