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they concluded that the NDR behavior
appears because of the bias-driven electronic structure change
from one class of insulating phase to another through an
exceedingly delocalized conducting phase. The quantum transport
properties of a chain molecule were investigated by
Emberly et al.29 In their tight binding formalism, they concluded
that a saturation in net current through a molecular wire creates
a charge density wave and, as a consequence, weakening of
some molecular bonds take place. At a specific level of bond
weakening, the current through the molecular wire decreases
with the increase in bias, which in turn is responsible for the
NDR behavior of the system.
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