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Ultrafast molecular dynamics in ionized 1- And 2-propanol- And simple fragmentation to complex isomerization and roaming mechanisms

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dc.contributor.affiliationDepartment of Physics, University of Connecticut, Storrs, CO 06269, United States; Departamento de Química, Universidad Autónoma de Madrid, Módulo 13, EU, Madrid, 28049, Spain; Condensed Matter Physics Center (IFIMAC), Universidad Autónoma de Madrid, Madrid, 28049, Spain; Institute for Advanced Research in Chemical Sciences(IAdChem), Universidad Autónoma de Madrid, Madrid, 28049, Spain; Instituto Madrileño de Estudios Avanzados en Nanociencia (IMDEA-Nano), Campus de Cantoblanco, Madrid, 28049, Spain; Donostia International Physics Center (DIPC), Paseo Manuel de Lardizabal 4, EU, Donostia-San Sebastián, 20018, Spainen
dc.contributor.affiliation000000041762408X
dc.contributor.authorMishra D.
dc.contributor.authorReino-González J.
dc.contributor.authorObaid R.
dc.contributor.authorLaForge A.C.
dc.contributor.authorDíaz-Tendero S.
dc.contributor.authorMartín, Fernando
dc.contributor.authorBerrah N.
dc.date.accessioned2022-01-11T09:05:19Z
dc.date.available2022-01-11T09:05:19Z
dc.date.issued2022
dc.identifier.doi10.1039/d1cp04011a
dc.identifier.urihttp://hdl.handle.net/20.500.12614/2776
dc.journal.titlePhysical Chemistry Chemical Physics
dc.language.isoen
dc.page.initial433
dc.relation.projectIDinfo:eu:eu-repo/grantAgreement/NSF/MPS%2FOAD/1700551/US/Visualizing Molecular Dynamics in Large Molecules using Intense, femtosecond, Pump-Probe Laser Pulses/
dc.relation.projectIDTEMPThe experimental work was funded by the National Science Foundation under award No. 1700551. The calculation was funded by the MICINN (MCIN/AEI/10.13039/501100011033) projects PID2019-105458RB-I00 and PID2019-110091GB-I00, ‘Severo Ochoa’ Programme for Centres of Excellence in R & D (SEV-2016-0686) and ‘María de Maeztu’ Programme for Units of Excellence in R & D (CEX2018-000805-M). We acknowledge the generous allocation of computer time at the Centro de Compu-tación Científica at the Universidad Autónoma de Madrid (CCC-UAM). Debadarshini Mishra acknowledges Sachin Vaidya for helpful discussions on the topic.
dc.rightsAtribución-NoComercial-SinDerivadas 3.0 España*
dc.rights.urihttp://creativecommons.org/licenses/by-nc-nd/3.0/es/*
dc.titleUltrafast molecular dynamics in ionized 1- And 2-propanol- And simple fragmentation to complex isomerization and roaming mechanisms
dc.typeresearch article
dc.volume.number24
dspace.entity.typePublication
relation.isAuthorOfPublication23d66601-f50b-4d29-aa9c-5effea58cfdf
relation.isAuthorOfPublication.latestForDiscovery23d66601-f50b-4d29-aa9c-5effea58cfdf

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