Computational Study of Allotropic Structures of Carbon by Density Functional Theory (DTF)
| dc.citation.epage | 162 | |
| dc.citation.issue | 19 | |
| dc.citation.journalAbbreviatedTitle | ing.cienc. | eng |
| dc.citation.journalTitle | Ingeniería y Ciencia | eng |
| dc.citation.spage | 145 | |
| dc.citation.volume | 10 | |
| dc.contributor.affiliation | Universidad del Valle | spa |
| dc.contributor.author | Gonzalez Carmona, Juan Manuel | spa |
| dc.contributor.author | Ortega Portilla, Carolina | spa |
| dc.contributor.author | Barbosa, Christian | spa |
| dc.contributor.author | Ruden Muñoz, Alexander | spa |
| dc.contributor.author | Sequeda Osorio, Federico | spa |
| dc.coverage.spatial | Medellín de: Lat: 06 15 00 N degrees minutes Lat: 6.2500 decimal degrees Long: 075 36 00 W degrees minutes Long: -75.6000 decimal degrees | eng |
| dc.date | 2014-01-31 | |
| dc.date.accessioned | 2019-11-22T16:48:31Z | |
| dc.date.available | 2019-11-22T16:48:31Z | |
| dc.date.issued | 2014-01-31 | |
| dc.description | In this paper using Density Functional Theory (DFT), the principal carbon allotropic crystalline structures (Diamond, graphite, nanotube y fullerene - C60) were simulated. The results shows diamond sp3 bonds formation between carbon atoms and low reactivi | eng |
| dc.description | En este artículo, utilizando la Teoría funcional de la densidad (DFT), se simularon las principales estructuras cristalinas alotrópicas de carbono (diamante, grafito, nanotubo y fullereno - C60). Los resultados muestran la formación de enlaces sp3 de diam | spa |
| dc.format | application/pdf | |
| dc.identifier.doi | 10.17230/ingciencia.10.19.7 | |
| dc.identifier.issn | 2256-4314 | |
| dc.identifier.issn | 1794-9165 | |
| dc.identifier.uri | http://hdl.handle.net/10784/14388 | |
| dc.language.iso | spa | spa |
| dc.publisher | Universidad EAFIT | spa |
| dc.relation.isversionof | http://publicaciones.eafit.edu.co/index.php/ingciencia/article/view/1928 | |
| dc.relation.uri | http://publicaciones.eafit.edu.co/index.php/ingciencia/article/view/1928 | |
| dc.rights | Copyright (c) 2014 Juan Manuel Gonzalez Carmona, Carolina Ortega Portilla, Christian Barbosa, Alexander Ruden Muñoz, Federico Sequeda Osorio | eng |
| dc.rights.accessrights | info:eu-repo/semantics/openAccess | eng |
| dc.rights.local | Acceso abierto | spa |
| dc.source | instname:Universidad EAFIT | |
| dc.source | reponame:Repositorio Institucional Universidad EAFIT | |
| dc.source | Ingeniería y Ciencia; Vol 10, No 19 (2014) | spa |
| dc.subject.keyword | Dft | eng |
| dc.subject.keyword | Computational Simulation | eng |
| dc.subject.keyword | Allotropic Structures | eng |
| dc.subject.keyword | Molecular Orbital | eng |
| dc.subject.keyword | Electrostatic Potential | eng |
| dc.subject.keyword | Dft | spa |
| dc.subject.keyword | Simulación Computacional | spa |
| dc.subject.keyword | Estructuras Alotrópicas | spa |
| dc.subject.keyword | Orbital Molecular | spa |
| dc.subject.keyword | Potencial Electrostático | spa |
| dc.title | Computational Study of Allotropic Structures of Carbon by Density Functional Theory (DTF) | eng |
| dc.title | Estudio computacional de las estructuras alotrópicas del carbono utilizando Teoría de Funcionales de Densidad (DFT) | spa |
| dc.type | article | eng |
| dc.type | info:eu-repo/semantics/article | eng |
| dc.type | publishedVersion | eng |
| dc.type | info:eu-repo/semantics/publishedVersion | eng |
| dc.type.local | Artículo | spa |