JYX - Kernels and Graphs on M25 + H (kuvailutiedot)

Name: Kernels and Graphs on M25 + H
License: https://creativecommons.org/licenses/by/4.0/

dc.contributor.author	Kärkkäinen, Tommi
dc.contributor.author	Häkkinen, Hannu
dc.contributor.author	Malola, Sami
dc.contributor.author	Pihlajamäki, Antti
dc.coverage.temporal	2022-09-01 - 2023-06-06
dc.date.accessioned	2023-06-07T12:21:22Z
dc.date.available	2023-06-07T12:21:22Z
dc.date.issued	2023
dc.identifier.citation	Pihlajamäki, Antti; Kärkkäinen, Tommi; Malola, Sami; Häkkinen, Hannu. <i>Kernels and Graphs on M25 + H</i>. V. 31.3.2023. University of Jyväskylä. 10.17011/jyx/dataset/87521
dc.identifier.other	jyu-resd.183437874
dc.identifier.uri	https://jyx.jyu.fi/handle/123456789/87521
dc.description.abstract	Codes related to article "Graphs and Kernelized Learning Applied to Interactions of Hydrogen with Doped Gold Nanoparticle Electrocatalysts". There are two main types of codes: codes to transform a catalytic system of protected gold nanoparticle and a single hydrogen atom into a graph-based representation, and codes to run kernel-based machine learning methods to predict interaction energies between the nanoparticle and the hydrogen atom. This is a snapshot of the code dataset that has been taken on 06.06.2023. A more detailed description of the data and the address to the GitLab repository for the latest version of the code can be found from the parent dataset of this data publication.	en
dc.language.iso	eng
dc.publisher	University of Jyväskylä	en
dc.relation.ispartof	Pihlajamäki, Antti; Kärkkäinen, Tommi; Malola, Sami; Häkkinen, Hannu. (2023). <i>Kernels and Graphs on M25 + H (parent repository)</i>. University of Jyväskylä. <a href="https://doi.org/10.17011/jyx/dataset/87525">https://doi.org/10.17011/jyx/dataset/87525</a>
dc.rights	Creative Commons Attribution 4.0 International
dc.title	Kernels and Graphs on M25 + H	en
dc.type	dataset
dc.identifier.urn	URN:NBN:fi:jyu-202306073595
dc.contributor.tiedekunta	Matemaattis-luonnontieteellinen tiedekunta
dc.contributor.tiedekunta	Faculty of Mathematics and Science
dc.contributor.tiedekunta	Informaatioteknologian tiedekunta
dc.contributor.tiedekunta	Faculty of Information Technology
dc.contributor.laitos	Department of Physics
dc.contributor.laitos	Fysiikan laitos
dc.contributor.yliopisto	Jyväskylän yliopisto
dc.contributor.yliopisto	University of Jyväskylä
dc.type.uri	http://purl.org/coar/resource_type/c_ddb1
dc.identifier.doi	10.17011/jyx/dataset/87521
dc.rights.copyright	Pihlajamäki, Antti and University of Jyväskylä
dc.rights.accesslevel	openAccess
dc.relation.grantnumber	351579
dc.relation.grantnumber	351583
dc.relation.grantnumber	351582
dc.subject.yso	machine learning	en
dc.subject.yso	nanoparticles	en
dc.subject.yso	catalysts	en
dc.subject.yso	nanosciences	en
dc.subject.yso	catalysis	en
dc.subject.yso	nanomaterials	en
dc.subject.yso	nanomateriaalit	fi
dc.subject.yso	koneoppiminen	fi
dc.subject.yso	nanohiukkaset	fi
dc.subject.yso	katalyytit	fi
dc.subject.yso	nanotieteet	fi
dc.subject.yso	katalyysi	fi
jyx.subject.uri	http://www.yso.fi/onto/yso/p23451
jyx.subject.uri	http://www.yso.fi/onto/yso/p22976
jyx.subject.uri	http://www.yso.fi/onto/yso/p8704
jyx.subject.uri	http://www.yso.fi/onto/yso/p6228
jyx.subject.uri	http://www.yso.fi/onto/yso/p15480
jyx.subject.uri	http://www.yso.fi/onto/yso/p21846
dc.rights.url	https://creativecommons.org/licenses/by/4.0/
dc.relation.funder	Suomen Akatemia
dc.relation.funder	Academy of Finland
jyx.fundingprogram	Others, AoF
jyx.fundingprogram	Muut, SA