Literature DB >> 33243885

Capturing roaming molecular fragments in real time.

Tomoyuki Endo1,2, Simon P Neville3, Vincent Wanie1, Samuel Beaulieu1, Chen Qu4, Jude Deschamps1, Philippe Lassonde1, Bruno E Schmidt5, Hikaru Fujise6, Mizuho Fushitani6, Akiyoshi Hishikawa6,7, Paul L Houston8,9, Joel M Bowman10, Michael S Schuurman3,11, François Légaré12, Heide Ibrahim12.   

Abstract

Since the discovery of roaming as an alternative molecular dissociation pathway in formaldehyde (H2CO), it has been indirectly observed in numerous molecules. The phenomenon describes a frustrated dissociation with fragments roaming at relatively large interatomic distances rather than following conventional transition-state dissociation; incipient radicals from the parent molecule self-react to form molecular products. Roaming has been identified spectroscopically through static product channel-resolved measurements, but not in real-time observations of the roaming fragment itself. Using time-resolved Coulomb explosion imaging (CEI), we directly imaged individual "roamers" on ultrafast time scales in the prototypical formaldehyde dissociation reaction. Using high-level first-principles simulations of all critical experimental steps, distinctive roaming signatures were identified. These were rendered observable by extracting rare stochastic events out of an overwhelming background using the highly sensitive CEI method.
Copyright © 2020, American Association for the Advancement of Science.

Entities:  

Year:  2020        PMID: 33243885     DOI: 10.1126/science.abc2960

Source DB:  PubMed          Journal:  Science        ISSN: 0036-8075            Impact factor:   47.728


  6 in total

1.  Strong-Field-Induced Coulomb Explosion Imaging of Tribromomethane.

Authors:  Surjendu Bhattacharyya; Kurtis Borne; Farzaneh Ziaee; Shashank Pathak; Enliang Wang; Anbu Selvam Venkatachalam; Xiang Li; Nathan Marshall; Kevin D Carnes; Charles W Fehrenbach; Travis Severt; Itzik Ben-Itzhak; Artem Rudenko; Daniel Rolles
Journal:  J Phys Chem Lett       Date:  2022-06-21       Impact factor: 6.888

2.  Deep learning study of tyrosine reveals that roaming can lead to photodamage.

Authors:  Julia Westermayr; Michael Gastegger; Dóra Vörös; Lisa Panzenboeck; Florian Joerg; Leticia González; Philipp Marquetand
Journal:  Nat Chem       Date:  2022-06-02       Impact factor: 24.274

Review 3.  Quantitative molecular simulations.

Authors:  Kai Töpfer; Meenu Upadhyay; Markus Meuwly
Journal:  Phys Chem Chem Phys       Date:  2022-06-01       Impact factor: 3.945

4.  Filming ultrafast roaming-mediated isomerization of bismuth triiodide in solution.

Authors:  Eun Hyuk Choi; Jong Goo Kim; Jungmin Kim; Hosung Ki; Yunbeom Lee; Seonggon Lee; Kihwan Yoon; Joonghan Kim; Jeongho Kim; Hyotcherl Ihee
Journal:  Nat Commun       Date:  2021-08-05       Impact factor: 14.919

5.  Post-Ionization Dynamics of the Polar Molecule OCS in Asymmetric Laser Fields.

Authors:  Tomoyuki Endo; Karl Michael Ziems; Martin Richter; Friedrich G Fröbel; Akiyoshi Hishikawa; Stefanie Gräfe; François Légaré; Heide Ibrahim
Journal:  Front Chem       Date:  2022-04-08       Impact factor: 5.545

6.  Step-by-step state-selective tracking of fragmentation dynamics of water dications by momentum imaging.

Authors:  Travis Severt; Zachary L Streeter; Wael Iskandar; Kirk A Larsen; Averell Gatton; Daniel Trabert; Bethany Jochim; Brandon Griffin; Elio G Champenois; Matthew M Brister; Dylan Reedy; Demitri Call; Richard Strom; Allen L Landers; Reinhard Dörner; Joshua B Williams; Daniel S Slaughter; Robert R Lucchese; Thorsten Weber; C William McCurdy; Itzik Ben-Itzhak
Journal:  Nat Commun       Date:  2022-09-01       Impact factor: 17.694

  6 in total

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