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Paper

Ab initio NMR chemical-shift calculations based on the combined fragmentation method

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Department of Chemistry, National University of Singapore, 3 Science Drive 3, Singapore 117543
E-mail: chmbrpa@nus.edu.sg;
Fax: +65 6779 1691 ;
Tel: +65 6516 2846
Phys. Chem. Chem. Phys., 2013,15, 7541-7547

DOI: 10.1039/C3CP50406A
Received 29 Jan 2013, Accepted 04 Apr 2013
First published online 05 Apr 2013
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