dc.contributor.author | Maclot, Sylvain | |
dc.contributor.author | Lahl, Jan | |
dc.contributor.author | Peschel, Jasper | |
dc.contributor.author | Wikmark, Hampus | |
dc.contributor.author | Rudawski, Piotr | |
dc.contributor.author | Brunner, Fabian | |
dc.contributor.author | Coudert-Alteirac, Hélène | |
dc.contributor.author | Indrajith, Suvasthika | |
dc.contributor.author | Huber, Bernd A. | |
dc.contributor.author | Díaz-Tendero Victoria, Sergio | |
dc.contributor.author | Aguirre, Néstor F. | |
dc.contributor.author | Rousseau, Patrick | |
dc.contributor.author | Johnsson, Per | |
dc.contributor.other | UAM. Departamento de Física de la Materia Condensada | es |
dc.contributor.other | UAM. Departamento de Química | es |
dc.date.accessioned | 2020-05-25T11:20:39Z | |
dc.date.available | 2020-05-25T11:20:39Z | |
dc.date.issued | 2020-12-01 | |
dc.identifier.citation | Scientific Reports 10 (2020): 2884 | en_US |
dc.identifier.issn | 2045-2322 | |
dc.identifier.uri | http://hdl.handle.net/10486/691104 | |
dc.description.abstract | This work presents a photodissociation study of the diamondoid adamantane using extreme ultraviolet femtosecond pulses. The fragmentation dynamics of the dication is unraveled by the use of advanced ion and electron spectroscopy giving access to the dissociation channels as well as their energetics. To get insight into the fragmentation dynamics, we use a theoretical approach combining potential energy surface determination, statistical fragmentation methods and molecular dynamics simulations. We demonstrate that the dissociation dynamics of adamantane dications takes place in a two-step process: barrierless cage opening followed by Coulomb repulsion-driven fragmentation | en_US |
dc.description.sponsorship | This research was supported by the Swedish Research Council, the Swedish Foundation for Strategic Research and the Crafoord Foundation. This project has received funding from the European Union’s Horizon 2020 research and innovation program under the Marie Sklodowska-Curie Grant Agreement No. 641789 MEDEA and under grant agreement no 654148 Laserlab-Europe. The research was conducted in the framework of the International Associated Laboratory (LIA) Fragmentation DYNAmics of complex MOlecular systems - DYNAMO, funded by the Centre National de la Recherche Scientifique (CNRS). The authors acknowledge the generous allocation of computer time at the Centro de Computación Científica at the Universidad Autónoma de Madrid (CCC-UAM). This work was partially supported by the project CTQ2016-76061-P of the Spanish Ministerio de Economía y Competitividad (MINECO). Financial support from the MINECO through the "María de Maeztu” Program for Units of Excellence in R&D (MDM-2014-0377) is also acknowledged | en_US |
dc.format.extent | 12 pag. | en_US |
dc.format.mimetype | application/pdf | en |
dc.language.iso | eng | en |
dc.publisher | Nature Publishing Group | en_US |
dc.relation.ispartof | Scientific Reports | en_US |
dc.rights | © 2020, The Author(s) | en_US |
dc.subject.other | Diamondoid adamantane | en_US |
dc.subject.other | Ultraviolet femtosecond pulses | en_US |
dc.subject.other | Coulomb repulsion-driven fragmentation | en_US |
dc.title | Dissociation dynamics of the diamondoid adamantane upon photoionization by XUV femtosecond pulses | en_US |
dc.type | article | en |
dc.subject.eciencia | Física | es |
dc.subject.eciencia | Química | es |
dc.relation.publisherversion | https://doi.org/10.1038/s41598-020-59649-1 | |
dc.identifier.doi | 10.1038/s41598-020-59649-1 | |
dc.identifier.publicationfirstpage | 2884-1 | |
dc.identifier.publicationissue | 10 | |
dc.identifier.publicationlastpage | 2884-12 | |
dc.identifier.publicationvolume | 2020 | |
dc.relation.projectID | info:eu-repo/grantAgreement/EC/H2020/641789/EU//MEDEA | en_US |
dc.relation.projectID | info:eu-repo/grantAgreement/EC/H2020/654148/EU//Laserlab-Europe | en_US |
dc.relation.projectID | Gobierno de España. CTQ2016-76061-P | es_ES |
dc.relation.projectID | Gobierno de España. MDM-2014-0377 | es_ES |
dc.type.version | info:eu-repo/semantics/publishedVersion | en |
dc.rights.cc | Reconocimiento | es_ES |
dc.rights.accessRights | openAccess | en |
dc.authorUAM | Díaz-Tendero Victoria, Sergio (262857) | |
dc.facultadUAM | Facultad de Ciencias | |
dc.institutoUAM | Centro de Investigación en Física de la Materia Condensada (IFIMAC) | |
dc.institutoUAM | Instituto de Investigación Avanzada en Ciencias Químicas (IAdChem) | |