Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool

Detalhes bibliográficos
Autor(a) principal: Lenzi, Veniero
Data de Publicação: 2023
Outros Autores: Marques, L.
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
Texto Completo: https://hdl.handle.net/1822/85523
Resumo: Silver-ceramic nanocomposite coatings, such as TiN:Ag, are among the most interesting solutions to improve the machining and cutting process of hard-to-cut Ti alloys, since they combine the TiN matrix hardness with the lubricating and protective action of Ag nanoparticles. Therefore, it is important to understand how, when present, Ag distributes at the tool-workpiece interface and how it affects the tribolayer formation and the tool wear. Molecular dynamics simulation results, obtained using a MEAM-based force field, are presented here for the cutting process of a Ti workpiece with a TiN tool, with and without the presence of Ag at the interface, for different cutting speeds. Ag is shown to form a thin protective layer at the workpiece-tool interface that prevents a direct contact between the parts and greatly reduces the tool degradation. Our simulations confirm the importance of Ag in self-lubricating nanocomposite coatings to realize the machining of otherwise hard-to-cut materials.
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spelling Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated toolMolecular dynamicsNanocomposite coatingsSelf-lubricating coatingsCuttingWearScience & TechnologySilver-ceramic nanocomposite coatings, such as TiN:Ag, are among the most interesting solutions to improve the machining and cutting process of hard-to-cut Ti alloys, since they combine the TiN matrix hardness with the lubricating and protective action of Ag nanoparticles. Therefore, it is important to understand how, when present, Ag distributes at the tool-workpiece interface and how it affects the tribolayer formation and the tool wear. Molecular dynamics simulation results, obtained using a MEAM-based force field, are presented here for the cutting process of a Ti workpiece with a TiN tool, with and without the presence of Ag at the interface, for different cutting speeds. Ag is shown to form a thin protective layer at the workpiece-tool interface that prevents a direct contact between the parts and greatly reduces the tool degradation. Our simulations confirm the importance of Ag in self-lubricating nanocomposite coatings to realize the machining of otherwise hard-to-cut materials.This research was funded by the Portuguese Foundation for Science and Technology (FCT) in the framework of the Strategic Funding Contract UIDB/04650/2020 and under the project MCTool21 “Manufacturing of cutting tools for the 21st century: from nano-scale material design to numerical process simulation” (reference: POCI-01-0247-FEDER-045940), co-financed by the European Regional Development Fund, through Portugal 2020 (PT2020), and by the Competitiveness and Internationalization Operational Programme (COMPETE 2020). The authors acknowledge the Texas Advanced Computing Center (TACC) at The University of Texas at Austin for providing HPC resources that have contributed to the research results reported within this paper.Multidisciplinary Digital Publishing InstituteUniversidade do MinhoLenzi, VenieroMarques, L.2023-02-052023-02-05T00:00:00Zinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleapplication/pdfhttps://hdl.handle.net/1822/85523engLenzi, V.; Marques, L. Molecular Dynamics Simulation of Ti Metal Cutting Using a TiN:Ag Self-Lubricating Coated Tool. Materials 2023, 16, 1344. https://doi.org/10.3390/ma160413441996-194410.3390/ma16041344https://www.mdpi.com/1996-1944/16/4/1344info:eu-repo/semantics/openAccessreponame:Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)instname:Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãoinstacron:RCAAP2023-07-21T12:47:26Zoai:repositorium.sdum.uminho.pt:1822/85523Portal AgregadorONGhttps://www.rcaap.pt/oai/openaireopendoar:71602024-03-19T19:45:32.479843Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos) - Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãofalse
dc.title.none.fl_str_mv Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
title Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
spellingShingle Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
Lenzi, Veniero
Molecular dynamics
Nanocomposite coatings
Self-lubricating coatings
Cutting
Wear
Science & Technology
title_short Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
title_full Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
title_fullStr Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
title_full_unstemmed Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
title_sort Molecular dynamics simulation of Ti metal cutting using a TiN:Ag self-lubricating coated tool
author Lenzi, Veniero
author_facet Lenzi, Veniero
Marques, L.
author_role author
author2 Marques, L.
author2_role author
dc.contributor.none.fl_str_mv Universidade do Minho
dc.contributor.author.fl_str_mv Lenzi, Veniero
Marques, L.
dc.subject.por.fl_str_mv Molecular dynamics
Nanocomposite coatings
Self-lubricating coatings
Cutting
Wear
Science & Technology
topic Molecular dynamics
Nanocomposite coatings
Self-lubricating coatings
Cutting
Wear
Science & Technology
description Silver-ceramic nanocomposite coatings, such as TiN:Ag, are among the most interesting solutions to improve the machining and cutting process of hard-to-cut Ti alloys, since they combine the TiN matrix hardness with the lubricating and protective action of Ag nanoparticles. Therefore, it is important to understand how, when present, Ag distributes at the tool-workpiece interface and how it affects the tribolayer formation and the tool wear. Molecular dynamics simulation results, obtained using a MEAM-based force field, are presented here for the cutting process of a Ti workpiece with a TiN tool, with and without the presence of Ag at the interface, for different cutting speeds. Ag is shown to form a thin protective layer at the workpiece-tool interface that prevents a direct contact between the parts and greatly reduces the tool degradation. Our simulations confirm the importance of Ag in self-lubricating nanocomposite coatings to realize the machining of otherwise hard-to-cut materials.
publishDate 2023
dc.date.none.fl_str_mv 2023-02-05
2023-02-05T00:00:00Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv https://hdl.handle.net/1822/85523
url https://hdl.handle.net/1822/85523
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv Lenzi, V.; Marques, L. Molecular Dynamics Simulation of Ti Metal Cutting Using a TiN:Ag Self-Lubricating Coated Tool. Materials 2023, 16, 1344. https://doi.org/10.3390/ma16041344
1996-1944
10.3390/ma16041344
https://www.mdpi.com/1996-1944/16/4/1344
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Multidisciplinary Digital Publishing Institute
publisher.none.fl_str_mv Multidisciplinary Digital Publishing Institute
dc.source.none.fl_str_mv reponame:Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
instname:Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informação
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reponame_str Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
collection Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
repository.name.fl_str_mv Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos) - Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informação
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