Computational investigation of the role of counterions and reorganization energy in a switchable bistable [2]rotaxane

Journal of Physical Chemistry A

Volumn 115, Issue 26, 2011, Pages 7773-7777

  Foster, Michael E ^a   Sohlberg, Karl ^a  

^a DREXEL UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BISTABLE [2]ROTAXANES; BISTABLES; COMPUTATIONAL INVESTIGATION; COMPUTATIONALLY EFFICIENT; COUNTERIONS; DEVICE FUNCTIONALITY; DFT LEVELS; FUNCTIONAL PROTOTYPES; MOLECULAR ELECTRONIC DEVICE; PREDICTING PROPERTIES; RELATIVE STABILITIES; REORGANIZATION ENERGIES; ROTAXANES; SITE PREFERENCES; SWITCHABLE;

MOLECULAR ELECTRONICS; THERMOELECTRIC EQUIPMENT;

ELECTRIC CONDUCTANCE;

EID: 79959799334     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp202163j     Document Type: Article

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