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Optimising Nanoparticle Synthesis with Machine Learning and Genetic Algorithms: A Study on Crystallite Size and Luminescence

dc.contributor.authorDe Waele, Lena
dc.date.accessioned2025-08-29T16:01:18Z
dc.date.available2025-09-30T00:31:36Z
dc.date.issued2025-01-16
dc.description.abstract"Lanthanide-doped nanoparticles (NPs) have shown great potential in biomedical applications, particu- larly in imaging and targeted therapies, due to their unique photoluminescence (PL) properties (2,3). Recent advancements in machine learning (ML) offer new opportunities for optimising NP synthesis. ML enables algorithms to learn from data, potentially accelerating discoveries, but significant challenges remain (4–6). Additionally, genetic algorithms (GAs), inspired by natural selection, can efficiently search through complex parameter spaces, making them suitable for optimising synthesis conditions (7–9). This study explores the potential of artificial intelligence (AI), specifically combining ML and GAs, to model and optimise NaGdF4:Eu NP synthesis conditions, aiming to maximise crystallite sizes while maintaining a small particle size. Increasing crystallite size has been shown to enhance PL intensity in various doped NPs. This approach can accelerate biomedical advancements efficiently in terms of both time and resources. Our approach included feature selection, standardisation, and one-hot encoding to build robust models.(...)"pt_PT
dc.description.versionN/Apt_PT
dc.identifier.urihttp://hdl.handle.net/10362/187176
dc.language.isoengpt_PT
dc.peerreviewedyespt_PT
dc.publisherInstituto de Tecnologia Química e Biológica António Xavier. Universidade NOVA de Lisboapt_PT
dc.subjectNanoparticles,pt_PT
dc.subjectGenetic Algorithmspt_PT
dc.subjectCrystallisationpt_PT
dc.subjectMachine Learningpt_PT
dc.subjectOptimisationpt_PT
dc.titleOptimising Nanoparticle Synthesis with Machine Learning and Genetic Algorithms: A Study on Crystallite Size and Luminescencept_PT
dc.typemaster thesis
dspace.entity.typePublication
oaire.citation.conferencePlaceOeiras, Portugalpt_PT
person.familyNameDe Waele
person.givenNameLena
person.identifier.orcid0000-0002-9694-5206
rcaap.rightsopenAccesspt_PT
rcaap.typemasterThesispt_PT
relation.isAuthorOfPublication08441d17-f17c-4d22-a4ed-2110bb3131ba
relation.isAuthorOfPublication.latestForDiscovery08441d17-f17c-4d22-a4ed-2110bb3131ba

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