Theoretical calculation of carbon clusters
Structural parameters and energy have been calculated for C1-3 and C-9 clusters using density functional theory through the deMon program. The C1-3 clusters were fully optimized using deMon
| Autores: | , , , |
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| Tipo de recurso: | artículo |
| Estado: | Versión publicada |
| Fecha de publicación: | 1997 |
| País: | México |
| Institución: | Universidad Nacional Autónoma de México |
| Repositorio: | Sistema de Información de la Facultad de Ciencias, UNAM |
| OAI Identifier: | oai:repositorio.fciencias.unam.mx:11154/3361 |
| Acceso en línea: | http://hdl.handle.net/11154/3361 |
| Access Level: | acceso abierto |
| Palabra clave: | Chemistry, Physical Mathematics, Interdisciplinary Applications Physics, Atomic, Molecular & Chemical |
| Sumario: | Structural parameters and energy have been calculated for C1-3 and C-9 clusters using density functional theory through the deMon program. The C1-3 clusters were fully optimized using deMon |
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