Spatial models of the current density vector field, induced in theelectronic cloud of the acetylene and ethylene molecules by a uniform,time-independent magnetic field, are discussed in terms of topologicalstagnation graphs and three-dimensional streamline plots. The modelsare validated by documenting their ability to explain magnetic suscep-tibility and nuclear magnetic shieldings of carbon and hydrogen viarelated shielding density maps.

Ring current models for acetylene and ethylene molecules / S., Pelloni; Lazzeretti, Paolo. - In: CHEMICAL PHYSICS. - ISSN 0301-0104. - STAMPA. - 356:1-3(2009), pp. 153-163. [10.1016/j.chemphys.2008.10.048]

Ring current models for acetylene and ethylene molecules

LAZZERETTI, Paolo
2009

Abstract

Spatial models of the current density vector field, induced in theelectronic cloud of the acetylene and ethylene molecules by a uniform,time-independent magnetic field, are discussed in terms of topologicalstagnation graphs and three-dimensional streamline plots. The modelsare validated by documenting their ability to explain magnetic suscep-tibility and nuclear magnetic shieldings of carbon and hydrogen viarelated shielding density maps.
2009
356
1-3
153
163
Ring current models for acetylene and ethylene molecules / S., Pelloni; Lazzeretti, Paolo. - In: CHEMICAL PHYSICS. - ISSN 0301-0104. - STAMPA. - 356:1-3(2009), pp. 153-163. [10.1016/j.chemphys.2008.10.048]
S., Pelloni; Lazzeretti, Paolo
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11380/421776
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