{"title":"Tunneling and reflection above the repulsive Coulomb barrier of fullerene dianions","authors":"Bruno Concina, Christian Bordas","doi":"10.1016/j.cplett.2025.142003","DOIUrl":null,"url":null,"abstract":"<div><div>Isolated fullerene dianions exhibit a repulsive Coulomb barrier towards electron loss. A kinetic energy release distribution of thermionic emission from <span><math><msubsup><mi>C</mi><mn>84</mn><mrow><mn>2</mn><mo>−</mo></mrow></msubsup></math></span> has been measured in a velocity map imaging spectrometer and is compared with a detailed-balance model. A key point is the calculation of the transmission probability through and above the barrier. Previously published, a Wentzel-Kramers-Brillouin (WKB) approach included tunneling but disregarded reflection over the barrier. However, the two processes being at the same fundamental quantum level, reflection must be taken into account. We propose a refined model based on the WKB Kemble formula which includes both.</div></div>","PeriodicalId":273,"journal":{"name":"Chemical Physics Letters","volume":"868 ","pages":"Article 142003"},"PeriodicalIF":2.8000,"publicationDate":"2025-02-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Chemical Physics Letters","FirstCategoryId":"92","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0009261425001435","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Isolated fullerene dianions exhibit a repulsive Coulomb barrier towards electron loss. A kinetic energy release distribution of thermionic emission from has been measured in a velocity map imaging spectrometer and is compared with a detailed-balance model. A key point is the calculation of the transmission probability through and above the barrier. Previously published, a Wentzel-Kramers-Brillouin (WKB) approach included tunneling but disregarded reflection over the barrier. However, the two processes being at the same fundamental quantum level, reflection must be taken into account. We propose a refined model based on the WKB Kemble formula which includes both.
期刊介绍:
Chemical Physics Letters has an open access mirror journal, Chemical Physics Letters: X, sharing the same aims and scope, editorial team, submission system and rigorous peer review.
Chemical Physics Letters publishes brief reports on molecules, interfaces, condensed phases, nanomaterials and nanostructures, polymers, biomolecular systems, and energy conversion and storage.
Criteria for publication are quality, urgency and impact. Further, experimental results reported in the journal have direct relevance for theory, and theoretical developments or non-routine computations relate directly to experiment. Manuscripts must satisfy these criteria and should not be minor extensions of previous work.