IGLO Calculations of Phosphorus NMR Chemical Shifts
- 1 April 1993
- journal article
- Published by Taylor & Francis Ltd in Phosphorus, Sulfur, and Silicon and the Related Elements
- Vol. 77 (1-4), 105-108
- https://doi.org/10.1080/10426509308045630
Abstract
The IGLO-method1 (IGLO stands for Individual Gauge for Localized Orbitals) is a coupled Hartree-Fock (CHF) type method for the calculation of NMR shielding tensors and the magnetic susceptibilities of (closed shell) molecules.Keywords
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