Publication Date:
2009
Short description:
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]
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.
Iris type:
Articolo su rivista
Keywords:
magnetic-field induced currents; ring current models; acetylene; ethylene
List of contributors:
S., Pelloni; Lazzeretti, Paolo
Published in: