Literature DB >> 19093825

Graphene terahertz generators for molecular circuits and sensors.

Norma L Rangel1, Jorge M Seminario.   

Abstract

Using ab initio density functional theory methods, the optimized structure of the single-, double-, and triple-layered graphene nanoribbons with different stacking orders and edges is calculated along with their Raman spectrums. For each case studied, graphene is found to be a potential source of vibrational signals in the terahertz region of the spectrum when molecules or another layer are adsorbed in the surface; this effect is independent of the hydrogen presence at the edges, and the stacking order. The visible low-frequency modes increase with the addition of graphene layers, and the number of modes may be influenced by the type of edges. The monolayer shows better performance due to the lower number of vibrational modes. The nanoribbon with fewer modes at the terahertz range is used to show a potential application of graphene acting as a sensor of single molecules.

Entities:  

Year:  2008        PMID: 19093825     DOI: 10.1021/jp808181n

Source DB:  PubMed          Journal:  J Phys Chem A        ISSN: 1089-5639            Impact factor:   2.781


  7 in total

1.  Graphene-based pressure nano-sensors.

Authors:  Viacheslav Sorkin; Yong Wei Zhang
Journal:  J Mol Model       Date:  2011-02-02       Impact factor: 1.810

2.  Coupling of mechanical and electronic properties of carbon nanotubes.

Authors:  Dahiyana Cristancho; Laura Benitez; Jorge M Seminario
Journal:  J Mol Model       Date:  2013-10-15       Impact factor: 1.810

3.  Interfacial adhesion between functionalized polyethylene surface and graphene via molecular dynamic simulation.

Authors:  S Javan Nikkhah; M R Moghbeli; S M Hashemianzadeh
Journal:  J Mol Model       Date:  2015-04-19       Impact factor: 1.810

4.  Harmonic force field for nitro compounds.

Authors:  Edson P Bellido; Jorge M Seminario
Journal:  J Mol Model       Date:  2011-11-27       Impact factor: 1.810

5.  A density functional theory analysis for the adsorption of the amine group on graphene and boron nitride nanosheets.

Authors:  Ernesto Chigo Anota; Alejandro Rodríguez Juárez; Miguel Castro; Heriberto Hernández Cocoletzi
Journal:  J Mol Model       Date:  2012-08-15       Impact factor: 1.810

6.  On the influence of point defects on the structural and electronic properties of graphene-like sheets: a molecular simulation study.

Authors:  Ernesto Chigo Anota; Alejandro Escobedo-Morales; Martin Salazar Villanueva; Odilon Vázquez-Cuchillo; Efrain Rubio Rosas
Journal:  J Mol Model       Date:  2012-10-14       Impact factor: 1.810

7.  Direct writing of graphene patterns on insulating substrates under ambient conditions.

Authors:  Wei Xiong; Yun Shen Zhou; Wen Jia Hou; Li Jia Jiang; Yang Gao; Li Sha Fan; Lan Jiang; Jean Francois Silvain; Yong Feng Lu
Journal:  Sci Rep       Date:  2014-05-08       Impact factor: 4.379

  7 in total

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