Systematic Theoretical Study of Structures and Bondings of the Charge-Transfer Complexes of Ammonia with HX, XY, and X2(X and Y are Halogens)

1997 ◽  
Vol 101 (15) ◽  
pp. 2879-2885 ◽  
Author(s):  
Yong Zhang ◽  
Cun-Yuan Zhao ◽  
Xiao-Zeng You
Keyword(s):  
Charge Transfer ◽  
Theoretical Study ◽  
Charge Transfer Complexes

X-Ray and Theoretical Study of Cyclophane-tetracyanoethylene Charge Transfer Complexes

1988 ◽  
Vol 164 (1) ◽  
pp. 179-195 ◽  
Author(s):  
Anne Renault ◽  
Claudine Cohen-addad ◽  
Janine Lajzerowicz ◽  
Enric Canadell ◽  
Odile Eisenstein
Keyword(s):  
Charge Transfer ◽  
Theoretical Study ◽  
Charge Transfer Complexes ◽  
X Ray

Theoretical study of charge transfer complexes between antithyroid thioamides and TCNE: Thermodynamics of the complex formation

2015 ◽  
Vol 1051 ◽  
pp. 129-136 ◽  
Author(s):  
Šimon Budzák ◽  
Pavel Mach ◽  
György Juhász ◽  
Miroslav Medved’ ◽  
Ondrej Kysel’
Keyword(s):  
Charge Transfer ◽  
Complex Formation ◽  
Theoretical Study ◽  
Charge Transfer Complexes

Charge Transfer Complexes Formed by Heterocyclic Thioamides and Tetracyanoethylene: Experimental and Theoretical Study

2017 ◽  
Vol 121 (37) ◽  
pp. 7000-7008 ◽  
Author(s):  
Tatiana S. Kolesnikova ◽  
Margarita S. Chernov’yants ◽  
Mikhail E. Kletskii ◽  
Oleg N. Burov ◽  
Gennady I. Bondarenko ◽  
...  
Keyword(s):  
Charge Transfer ◽  
Theoretical Study ◽  
Charge Transfer Complexes ◽  
Heterocyclic Thioamides

Theoretical Study of Staging Structure in the Neutral-Ionic Transition of Charge-Transfer Complexes

2002 ◽  
Vol 75 (7-8) ◽  
pp. 831-837 ◽  
Author(s):  
T. Iizuka-sakano ◽  
T. Kawamoto ◽  
Y. Shimoi ◽  
S. Abe
Keyword(s):  
Charge Transfer ◽  
Theoretical Study ◽  
Charge Transfer Complexes ◽  
Ionic Transition

TTF derivative of 2,5-aromatic disubstituted pyrroles, experimental and theoretical study

2016 ◽  
Vol 1819 ◽  
Author(s):  
Lioudmila Fomina ◽  
Christopher León ◽  
Montserrat Bizarro ◽  
Alejandro Baeza ◽  
Victoria Gómez-Vidales ◽  
...  
Keyword(s):  
Charge Transfer ◽  
Theoretical Study ◽  
Charge Transfer Complex ◽  
Theoretical Calculations ◽  
Organic Conductors ◽  
Charge Transfer Complexes ◽  
New Materials ◽  
Research Groups ◽  
Molecular Adduct ◽  
Object Of Study

ABSTRACTIn the last decades the interest in organic conductors has growth, so they have become the object of study of many research groups that are interested in developing new materials with important conducting properties. The charge transfer complexes (CTC) represent an important kind of organic conductors, because they exhibit high conductivity values, as well as versatility for their design.In this work, the charge transfer complex (CTC) formed by substituted pyrrole and tetrathiofulvalene (TTF) was obtained by means electrochemical synthesis, the resultant colored mix was characterized by Mass spectrometry, NMR and EPR studies, its intrinsic electronic behavior was measured by a four point probe method, besides theoretical calculations were carried out on the possible structures of the resultant molecular adduct. All the results show that there is a net transfer of an electron between both organic moieties in a solution giving place to a semiconductor species.

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