Química Física y Química Inorgánica
Departamento
![Foto de Andrés](/img/nophoto.png)
Andrés
Garzón Ruiz
Publicaciones en las que colabora con Andrés Garzón Ruiz (17)
2016
-
DFT study of the effect of fluorine atoms on the crystal structure and semiconducting properties of poly(arylene-ethynylene) derivatives
Journal of Chemical Physics, Vol. 144, Núm. 15
2015
-
DFT study of the ambipolar character of polymers on the basis of s-tetrazine and aryl rings
Journal of Physical Chemistry C, Vol. 119, Núm. 9, pp. 4588-4599
2014
-
Electronic structure and charge transport properties of a series of 3,6-(diphenyl)-s-tetrazine derivatives: Are they suitable candidates for molecular electronics?
Journal of Physical Chemistry C, Vol. 118, Núm. 46, pp. 26427-26439
-
Theoretical estimation of the optical bandgap in a series of poly(aryl-ethynylene)s: A DFT study
Journal of Chemical Physics, Vol. 140, Núm. 4
2013
-
A tuned LRC-DFT design of ambipolar diketopyrrolopyrrole-containing quinoidal molecules interesting for molecular electronics
Journal of Chemical Theory and Computation, Vol. 9, Núm. 6, pp. 2591-2601
-
Crystal structure and charge transport properties of poly(arylene- ethynylene) derivatives: A DFT approach
Journal of Chemical Physics, Vol. 138, Núm. 15
-
Theoretical approach to the study of thiophene-based discotic systems as organic semiconductors
Journal of Physical Chemistry C, Vol. 117, Núm. 1, pp. 15-22
2012
-
Electronic properties of diphenyl-s-tetrazine and some related oligomers. An spectroscopic and theoretical study
Chemical Physics, Vol. 408, pp. 17-27
-
Poly(arylenethynyl-thienoacenes) as candidates for organic semiconducting materials. A DFT insight
Organic Electronics, Vol. 13, Núm. 12, pp. 3244-3253
2011
-
Does the number of nitrogen atoms have an influence on the conducting properties of diphenylazines? A DFT insight
Chemical Physics, Vol. 379, Núm. 1-3, pp. 51-56
-
Optoelectronic and charge transport properties of oligomers based on phenylethynylene units linked to thieno-acenes: A DFT study
Journal of Physical Chemistry C, Vol. 115, Núm. 14, pp. 6922-6932
-
Theoretical study of the effect of alkyl and alkoxy lateral chains on the structural and electronic properties of π-conjugated polymers consisting of phenylethynyl-1,3,4-thiadiazole
Journal of Physical Chemistry C, Vol. 115, Núm. 6, pp. 2865-2873
2010
-
Density functional theory study of the optical and electronic properties of oligomers based on phenyl-ethynyl units linked to triazole, thiadiazole, and oxadiazole rings to be used in molecular electronics
Journal of Chemical Physics, Vol. 132, Núm. 6
-
Molecular structure, conformational preferences and vibrational analysis of 2-hydroxystyrene: A computational and spectroscopic research
Chemical Physics, Vol. 374, Núm. 1-3, pp. 62-76
-
The role of linear alkyl and alkoxy side chains in the modulation of the structure and electrical properties of bithiophene:a theoretical study
Australian Journal of Chemistry
-
Theoretical study of Bis(phenylethynyl)thienoacenes as precursors of molecular wires for molecular electronics
Journal of Physical Chemistry C, Vol. 114, Núm. 28, pp. 12325-12334
2009
-
Theoretical study of the effect of ethynyl group on the structure and electrical properties of phenyl-thiadiazole systems as precursors of electron-conducting materials
Journal of Chemical Physics, Vol. 130, Núm. 23