| 1 |
The role of electrostatic interactions and solvent polarity on the N-15 NMR shielding of azines
Modesto-Costa L, Gester RM, Manzoni V
Chemical Physics Letters, 686, 189, 2017 |
| 2 |
Ab Initio Calculations of Co Shielding in Model Complexes
Moore EA
International Journal of Molecular Sciences, 3(8), 873, 2002 |
| 3 |
Mixed uranium chloride fluorides UF6-nCln and methoxyuranium fluorides UF6-n(OCH3)(n): A theoretical study of equilibrium geometries, vibrational frequencies, and the role of the f orbitals
Schreckenbach G
Inorganic Chemistry, 39(6), 1265, 2000 |
| 4 |
A New Graphical Model for Proton NMR (De)shielding over a Carbon-Carbon Double Bond to Replace the Shielding Cone Model
Martin NH, Brown JD
International Journal of Molecular Sciences, 1(4), 84, 2000 |
| 5 |
The Calculation of Se-77 Chemical-Shifts Using Gauge Including Atomic Orbitals and Density-Functional Theory
Schreckenbach G, Ruizmorales Y, Ziegler T
Journal of Chemical Physics, 104(21), 8605, 1996 |
| 6 |
Coupled Hartree-Fock Calculations of Molecular Magnetic-Properties Annihilating the Transverse Paramagnetic Current-Density
Zanasi R
Journal of Chemical Physics, 105(4), 1460, 1996 |
| 7 |
2-Dipole Magnetic-Field Density-Functional Theory
Grayce CJ, Harris RA
Journal of Physical Chemistry, 99(9), 2724, 1995 |
| 8 |
Density-Functional Study of Magnetic Coupling Parameters - Reconciling Theory and Experiment for the Tif3 Complex
Belanzoni P, Baerends EJ, Vanasselt S, Langewen PB
Journal of Physical Chemistry, 99(35), 13094, 1995 |
| 9 |
The Hyperfine Structures of Small Radicals from Density-Functional Calculations
Eriksson LA, Malkina OL, Malkin VG, Salahub DR
Journal of Chemical Physics, 100(7), 5066, 1994 |
