Prediction of structures and related properties of silicon clusters
Silicon is one of the most important semi conducting materials employed in microelectronic technologies. This chapter is dedicated to review the enormous effort made during the last years to develop confident methods to determinate the geometries and related properties of silicon clusters. Searching...
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paper:paper_14727978_v7_n3-4_p195_Ferraro2023-06-08T16:17:32Z Prediction of structures and related properties of silicon clusters Ferraro, Marta Beatriz Global optimization Microelectronics Molecular dynamics Silicon Structures (built objects) Conducting materials Generic structural motif Global optimization method Hybrid methodologies Local optimizations Microelectronic technologies Silicon clusters State of the art Structural optimization Silicon is one of the most important semi conducting materials employed in microelectronic technologies. This chapter is dedicated to review the enormous effort made during the last years to develop confident methods to determinate the geometries and related properties of silicon clusters. Searching employing full global optimization of the energy surface, using techniques like Molecular Dynamics (MD), algorithms, and local optimization of structures built onto generic structural motifs are reported. Hybrid methodologies combining tight-binding (TB) with global optimization methods also contribute to the state of the art in the prediction of the structures, and calculation of properties of silicon clusters, based on all-electron DFT methods are also included. © 2007 IOS Press and the authors. Fil:Ferraro, M.B. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. 2007 https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_14727978_v7_n3-4_p195_Ferraro http://hdl.handle.net/20.500.12110/paper_14727978_v7_n3-4_p195_Ferraro |
institution |
Universidad de Buenos Aires |
institution_str |
I-28 |
repository_str |
R-134 |
collection |
Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) |
topic |
Global optimization Microelectronics Molecular dynamics Silicon Structures (built objects) Conducting materials Generic structural motif Global optimization method Hybrid methodologies Local optimizations Microelectronic technologies Silicon clusters State of the art Structural optimization |
spellingShingle |
Global optimization Microelectronics Molecular dynamics Silicon Structures (built objects) Conducting materials Generic structural motif Global optimization method Hybrid methodologies Local optimizations Microelectronic technologies Silicon clusters State of the art Structural optimization Ferraro, Marta Beatriz Prediction of structures and related properties of silicon clusters |
topic_facet |
Global optimization Microelectronics Molecular dynamics Silicon Structures (built objects) Conducting materials Generic structural motif Global optimization method Hybrid methodologies Local optimizations Microelectronic technologies Silicon clusters State of the art Structural optimization |
description |
Silicon is one of the most important semi conducting materials employed in microelectronic technologies. This chapter is dedicated to review the enormous effort made during the last years to develop confident methods to determinate the geometries and related properties of silicon clusters. Searching employing full global optimization of the energy surface, using techniques like Molecular Dynamics (MD), algorithms, and local optimization of structures built onto generic structural motifs are reported. Hybrid methodologies combining tight-binding (TB) with global optimization methods also contribute to the state of the art in the prediction of the structures, and calculation of properties of silicon clusters, based on all-electron DFT methods are also included. © 2007 IOS Press and the authors. |
author |
Ferraro, Marta Beatriz |
author_facet |
Ferraro, Marta Beatriz |
author_sort |
Ferraro, Marta Beatriz |
title |
Prediction of structures and related properties of silicon clusters |
title_short |
Prediction of structures and related properties of silicon clusters |
title_full |
Prediction of structures and related properties of silicon clusters |
title_fullStr |
Prediction of structures and related properties of silicon clusters |
title_full_unstemmed |
Prediction of structures and related properties of silicon clusters |
title_sort |
prediction of structures and related properties of silicon clusters |
publishDate |
2007 |
url |
https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_14727978_v7_n3-4_p195_Ferraro http://hdl.handle.net/20.500.12110/paper_14727978_v7_n3-4_p195_Ferraro |
work_keys_str_mv |
AT ferraromartabeatriz predictionofstructuresandrelatedpropertiesofsiliconclusters |
_version_ |
1768542237065478144 |