The calculation of nuclear spin coupling constants from Ab Initio wavefunctions
Author:
Publisher
Elsevier BV
Subject
General Engineering
Reference8 articles.
1. Self‐Consistent Perturbation Theory. I. Finite Perturbation Methods
2. Self‐Consistent Perturbation Theory. II. Nuclear‐Spin Coupling Constants
3. Self‐Consistent Orbitals for Radicals
4. Perturbational Calculations of the Nuclear Spin—Spin Coupling Constant for the Hydrogen Fluoride Molecule
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1. A critical analysis of electronic density functionals for structural, energetic, dynamic, and magnetic properties of hydrogen fluoride clusters;Journal of Computational Chemistry;1997-11-15
2. Spin–spin coupling constants of CO and N2;The Journal of Chemical Physics;1987-08-15
3. The nuclear shielding derivative and spin–spin coupling in nitrogen;The Journal of Chemical Physics;1985-10
4. Isotope shifts and spin–spin coupling constants in the13C and17O NMR spectra of carbon monoxide and carbon dioxide;The Journal of Chemical Physics;1985-07-15
5. Application of the equations‐of‐motion method to the calculation of the indirect nuclear spin–spin coupling tensors;The Journal of Chemical Physics;1985-01-15
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