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Ultra-fast laser pulses as a probe of electron dynamics : a next generation QTAIM perspective
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dc.contributor.author | He, Huan | |
dc.contributor.author | Peng Mi, Xiao | |
dc.contributor.author | Zhou, Xinjie | |
dc.contributor.author | Hong, Genwei | |
dc.contributor.author | Xu, Tianlv | |
dc.contributor.author | Früchtl, Herbert | |
dc.contributor.author | van Mourik, Tanja | |
dc.contributor.author | Paterson, Martin J. | |
dc.contributor.author | Kirk, Steven R. | |
dc.contributor.author | Jenkins, Samantha | |
dc.date.accessioned | 2024-01-10T11:30:13Z | |
dc.date.available | 2024-01-10T11:30:13Z | |
dc.date.issued | 2024-01-16 | |
dc.identifier | 297438197 | |
dc.identifier | 9d6fa928-301d-480a-97f5-2ecd1179332d | |
dc.identifier | 85179155397 | |
dc.identifier.citation | He , H , Peng Mi , X , Zhou , X , Hong , G , Xu , T , Früchtl , H , van Mourik , T , Paterson , M J , Kirk , S R & Jenkins , S 2024 , ' Ultra-fast laser pulses as a probe of electron dynamics : a next generation QTAIM perspective ' , Chemical Physics Letters , vol. 835 , 141018 . https://doi.org/10.1016/j.cplett.2023.141018 | en |
dc.identifier.issn | 0009-2614 | |
dc.identifier.other | RIS: urn:83810CF04AD442C12534A3C32703FD00 | |
dc.identifier.other | ORCID: /0000-0001-6647-4266/work/148887872 | |
dc.identifier.other | ORCID: /0000-0001-7683-3293/work/148888319 | |
dc.identifier.uri | https://hdl.handle.net/10023/28977 | |
dc.description | The Hunan Natural Science Foundation of China project gratefully acknowledged approval number: 2022JJ30029. The One Hundred Talents Foundation of Hunan Province is also gratefully acknowledged for the support of S.J. and S.R.K. MJP thanks the EPSRC for funding through grants EP/T021675 and EP/V006746. | en |
dc.description.abstract | We investigate the construction of an ultra-fast laser probe to determine the response of the electron dynamics of ethane using next generation QTAIM (NG-QTAIM). This is undertaken by applying a pair of simulated left and right circularly polarized ultra-fast laser pulses of duration 10 fs. A proportional increase in the C-C BCP bond strain with peak electric field was discovered. NG-QTAIM was used to identify a characteristic morphology associated with ultra-fast laser probes. Candidate ultra-fast laser probes were selected on the basis of the ground state population remaining undisturbed at a time t = 15 fs. | |
dc.format.extent | 967547 | |
dc.format.extent | 784044 | |
dc.language.iso | eng | |
dc.relation.ispartof | Chemical Physics Letters | en |
dc.subject | Ultra-fast laser | en |
dc.subject | NG-QTAIM | en |
dc.subject | Ethane | en |
dc.subject | Laser probe | en |
dc.subject | Circularly polarized laser | en |
dc.subject | QD Chemistry | en |
dc.subject | E-NDAS | en |
dc.subject.lcc | QD | en |
dc.title | Ultra-fast laser pulses as a probe of electron dynamics : a next generation QTAIM perspective | en |
dc.type | Journal article | en |
dc.contributor.institution | University of St Andrews. School of Chemistry | en |
dc.contributor.institution | University of St Andrews. Centre for Research into Equality, Diversity & Inclusion | en |
dc.contributor.institution | University of St Andrews. EaSTCHEM | en |
dc.identifier.doi | https://doi.org/10.1016/j.cplett.2023.141018 | |
dc.description.status | Peer reviewed | en |
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