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Are accurate computations of the 13C' shielding feasible at the DFT level of theory?
(Wiley, 2014-02)
The goal of this study is twofold. First, to investigate the relative influence of the main structural factors affecting the computation of the 13C0 shielding, namely, the conformation of the residue itself and the next ...
Morphometry of terrestrial shield volcanoes
(Elsevier Science, 2018-03)
Shield volcanoes are described as low-angle edifices built primarily by the accumulation of successive lava flows. This generic view of shield volcano morphology is based on a limited number of monogenetic shields from ...
Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule
(John Wiley & Sons Ltd, 2005-12)
The differential Biot-Savart law of classical electrodynamics was applied to develop a ring current model for the magnetic shielding of the carbon nucleus in benzene. It is shown that the local effect of the π currents, ...
Unique magnetic shielding and bonding in Pnicogen nortricyclane Zintl clusters
(Elsevier B.V., 2020)