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High-resolution x-ray spectra of carbon monoxide reveal ultrafast dynamics induced by long UV pulse
North China Elect Power Univ, Dept Math & Phys, Beijing 102206, Peoples R China..
KTH, School of Engineering Sciences in Chemistry, Biotechnology and Health (CBH), Theoretical Chemistry and Biology. Siberian Fed Univ, Int Res Ctr Spect & Quantum Chem IRC SQC, Krasnoyarsk 660041, Russia..ORCID iD: 0000-0002-4792-9525
KTH, School of Engineering Sciences in Chemistry, Biotechnology and Health (CBH), Theoretical Chemistry and Biology. Siberian Fed Univ, Int Res Ctr Spect & Quantum Chem IRC SQC, Krasnoyarsk 660041, Russia..ORCID iD: 0000-0003-1269-8760
KTH, School of Engineering Sciences in Chemistry, Biotechnology and Health (CBH), Theoretical Chemistry and Biology. Siberian Fed Univ, Int Res Ctr Spect & Quantum Chem IRC SQC, Krasnoyarsk 660041, Russia.;Fed Res Ctr KSC SB RAS, Kirensky Inst Phys, Krasnoyarsk 660036, Russia.;Helmholtz Zentrum Berlin Mat & Energie, Inst Methods & Instrumentat Synchrotron Radiat Re, Albert Einstein Str 15, D-12489 Berlin, Germany..ORCID iD: 0000-0003-3072-3173
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2021 (English)In: New Journal of Physics, E-ISSN 1367-2630, Vol. 23, no 6, article id 063030Article in journal (Refereed) Published
Abstract [en]

In theoretical simulations of a UV + x-ray pump-probe (UVX-PP) setup, we show that frequency detuning of the pump UV pulse acts as a camera shutter by regulating the duration of the UVX-PP process. This two-photon absorption with long overlapping UV and x-ray pulses, allowing for high spectral resolution, thereby provides information about ultrafast dynamics of the nuclear wave packet without the requirement of ultrashort pulses and controlled delay times. In a case study of carbon monoxide, the calculated UVX-PP spectra of the O1s (-1)2 pi (1) and C1s (-1)2 pi (1) core-excited states show different vibrational profiles. The interference of intermediate vibrational states reveals details of nuclear dynamics in the UVX-PP process related to a variable duration time controlled by the UV detuning. Both O1s (-1)2 pi (1) and C1s (-1)2 pi (1) pump-probe channels display a splitting of the spectral profile, which however is associated with different physical mechanisms. At the O1s (-1)2 pi (1) resonance, the observed dispersive and non-dispersive spectral bands intersect and result in destructive interference.

Place, publisher, year, edition, pages
IOP Publishing , 2021. Vol. 23, no 6, article id 063030
Keywords [en]
UV pump-x-ray probe, molecular spectroscopy, ultrafast dynamics, potential energy surfaces, x-ray absorption
National Category
Atom and Molecular Physics and Optics Theoretical Chemistry
Identifiers
URN: urn:nbn:se:kth:diva-298685DOI: 10.1088/1367-2630/ac0198ISI: 000661257500001Scopus ID: 2-s2.0-85108800816OAI: oai:DiVA.org:kth-298685DiVA, id: diva2:1581223
Note

QC 20210720

Available from: 2021-07-20 Created: 2021-07-20 Last updated: 2024-03-18Bibliographically approved

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Savchenko, ViktoriiaKimberg, VictorGel'mukhanov, FarisOdelius, Michael

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