Determination of excited state molecular structures from time-resolved gas-phase X-ray scattering
Abstract
We present a comprehensive investigation of a recently introduced method to determine transient structures of molecules in excited electronic states with sub-ångstrom resolution from time-resolved gas-phase scattering signals.
- Authors:
-
- Brown Univ., Providence, RI (United States)
- Western Connecticut State Univ., Danbury, CT (United States)
- SLAC National Accelerator Lab., Menlo Park, CA (United States)
- Brown Univ., Providence, RI (United States); Univ. of Edinburgh (United Kingdom)
- Publication Date:
- Research Org.:
- Brown Univ., Providence, RI (United States); SLAC National Accelerator Lab., Menlo Park, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division; USDOE Office of Science (SC), Basic Energy Sciences (BES)
- OSTI Identifier:
- 1773828
- Alternate Identifier(s):
- OSTI ID: 1766091; OSTI ID: 1778939
- Grant/Contract Number:
- SC0017995; SC0020276; AC02-76SF00515
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Faraday Discussions
- Additional Journal Information:
- Journal Volume: 2021; Journal Issue: 228; Journal ID: ISSN 1359-6640
- Publisher:
- Royal Society of Chemistry
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 74 ATOMIC AND MOLECULAR PHYSICS; x-ray scattering; excited state molecular structures
Citation Formats
Yong, Haiwang, Carrascosa, Andrés Moreno, Ma, Lingyu, Stankus, Brian, Minitti, Michael P., Kirrander, Adam, and Weber, Peter M. Determination of excited state molecular structures from time-resolved gas-phase X-ray scattering. United States: N. p., 2020.
Web. doi:10.1039/d0fd00118j.
Yong, Haiwang, Carrascosa, Andrés Moreno, Ma, Lingyu, Stankus, Brian, Minitti, Michael P., Kirrander, Adam, & Weber, Peter M. Determination of excited state molecular structures from time-resolved gas-phase X-ray scattering. United States. https://doi.org/10.1039/d0fd00118j
Yong, Haiwang, Carrascosa, Andrés Moreno, Ma, Lingyu, Stankus, Brian, Minitti, Michael P., Kirrander, Adam, and Weber, Peter M. Wed .
"Determination of excited state molecular structures from time-resolved gas-phase X-ray scattering". United States. https://doi.org/10.1039/d0fd00118j. https://www.osti.gov/servlets/purl/1773828.
@article{osti_1773828,
title = {Determination of excited state molecular structures from time-resolved gas-phase X-ray scattering},
author = {Yong, Haiwang and Carrascosa, Andrés Moreno and Ma, Lingyu and Stankus, Brian and Minitti, Michael P. and Kirrander, Adam and Weber, Peter M.},
abstractNote = {We present a comprehensive investigation of a recently introduced method to determine transient structures of molecules in excited electronic states with sub-ångstrom resolution from time-resolved gas-phase scattering signals.},
doi = {10.1039/d0fd00118j},
journal = {Faraday Discussions},
number = 228,
volume = 2021,
place = {United States},
year = {Wed Nov 18 00:00:00 EST 2020},
month = {Wed Nov 18 00:00:00 EST 2020}
}
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Works referenced in this record:
Imaging Molecular Motion: Femtosecond X-Ray Scattering of an Electrocyclic Chemical Reaction
journal, June 2015
- Minitti, M. P.; Budarz, J. M.; Kirrander, A.
- Physical Review Letters, Vol. 114, Issue 25
Chemical Applications of X-ray Charge-Density Analysis
journal, June 2001
- Koritsanszky, Tibor S.; Coppens, Philip
- Chemical Reviews, Vol. 101, Issue 6
Ultrafast Diffraction Imaging of the Electrocyclic Ring-Opening Reaction of 1,3-Cyclohexadiene
journal, May 2001
- Dudek, Ray C.; Weber, Peter M.
- The Journal of Physical Chemistry A, Vol. 105, Issue 17
Imaging CF 3 I conical intersection and photodissociation dynamics with ultrafast electron diffraction
journal, July 2018
- Yang, Jie; Zhu, Xiaolei; Wolf, Thomas J. A.
- Science, Vol. 361, Issue 6397
The Morse oscillator in position space, momentum space, and phase space
journal, April 1988
- Dahl, Jens Peder; Springborg, Michael
- The Journal of Chemical Physics, Vol. 88, Issue 7
Pixel array detector for X-ray free electron laser experiments
journal, September 2011
- Philipp, Hugh T.; Hromalik, Marianne; Tate, Mark
- Nuclear Instruments and Methods in Physics Research Section A: Accelerators, Spectrometers, Detectors and Associated Equipment, Vol. 649, Issue 1
Simultaneous observation of nuclear and electronic dynamics by ultrafast electron diffraction
journal, May 2020
- Yang, Jie; Zhu, Xiaolei; F. Nunes, J. Pedro
- Science, Vol. 368, Issue 6493
Excited Electronic States in Total Isotropic Scattering from Molecules
journal, March 2020
- Zotev, Nikola; Moreno Carrascosa, Andrés; Simmermacher, Mats
- Journal of Chemical Theory and Computation, Vol. 16, Issue 4
First lasing and operation of an ångstrom-wavelength free-electron laser
journal, August 2010
- Emma, P.; Akre, R.; Arthur, J.
- Nature Photonics, Vol. 4, Issue 9
The photochemical ring-opening of 1,3-cyclohexadiene imaged by ultrafast electron diffraction
journal, April 2019
- Wolf, T. J. A.; Sanchez, D. M.; Yang, J.
- Nature Chemistry, Vol. 11, Issue 6
Determining Orientations of Optical Transition Dipole Moments Using Ultrafast X-ray Scattering
journal, October 2018
- Yong, Haiwang; Zotev, Nikola; Stankus, Brian
- The Journal of Physical Chemistry Letters, Vol. 9, Issue 22
Ab Initio Calculation of Total X-ray Scattering from Molecules
journal, March 2019
- Moreno Carrascosa, Andrés; Yong, Haiwang; Crittenden, Deborah L.
- Journal of Chemical Theory and Computation, Vol. 15, Issue 5
Energy Flow and Fragmentation Dynamics of N,N -Dimethylisopropylamine
journal, March 2006
- Gosselin, Jaimie L.; Minitti, Michael P.; Rudakov, Fedor M.
- The Journal of Physical Chemistry A, Vol. 110, Issue 12
Advances in ultrafast gas-phase x-ray scattering
journal, November 2020
- Stankus, Brian; Yong, Haiwang; Ruddock, Jennifer
- Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 53, Issue 23
Ab Initio Calculation of Molecular Diffraction
journal, October 2014
- Northey, Thomas; Zotev, Nikola; Kirrander, Adam
- Journal of Chemical Theory and Computation, Vol. 10, Issue 11
On the interpretation of time-resolved anisotropic diffraction patterns
journal, November 2010
- Lorenz, U.; Møller, K. B.; Henriksen, N. E.
- New Journal of Physics, Vol. 12, Issue 11
Ultrafast X-ray scattering reveals vibrational coherence following Rydberg excitation
journal, July 2019
- Stankus, Brian; Yong, Haiwang; Zotev, Nikola
- Nature Chemistry, Vol. 11, Issue 8
Observation of the molecular response to light upon photoexcitation
journal, May 2020
- Yong, Haiwang; Zotev, Nikola; Ruddock, Jennifer M.
- Nature Communications, Vol. 11, Issue 1
X-ray imaging of chemically active valence electrons during a pericyclic reaction
journal, November 2014
- Bredtmann, Timm; Ivanov, Misha; Dixit, Gopal
- Nature Communications, Vol. 5, Issue 1
Electron Densities from Gas‐Phase Electron Diffraction Intensities. I. Preliminary Considerations
journal, October 1969
- Kohl, D. A.; Bartell, L. S.
- The Journal of Chemical Physics, Vol. 51, Issue 7
Observation of femtosecond molecular dynamics via pump–probe gas phase x-ray scattering
journal, January 2016
- Budarz, J. M.; Minitti, M. P.; Cofer-Shabica, D. V.
- Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 49, Issue 3
Ultrafast X-ray Diffraction Theory
journal, November 1998
- Cao, Jianshu; Wilson, Kent R.
- The Journal of Physical Chemistry A, Vol. 102, Issue 47
Oscillatory Photoelectron Signal of N -Methylmorpholine as a Test Case for the Algebraic-Diagrammatic Construction Method of Second Order
journal, November 2018
- Dsouza, Raison; Cheng, Xinxin; Li, Zheng
- The Journal of Physical Chemistry A, Vol. 122, Issue 50
Elastic X-ray scattering from state-selected molecules
journal, October 2016
- Northey, Thomas; Moreno Carrascosa, Andrés; Schäfer, Steffen
- The Journal of Chemical Physics, Vol. 145, Issue 15
Mega-electron-volt ultrafast electron diffraction at SLAC National Accelerator Laboratory
journal, July 2015
- Weathersby, S. P.; Brown, G.; Centurion, M.
- Review of Scientific Instruments, Vol. 86, Issue 7
A MHz-repetition-rate hard X-ray free-electron laser driven by a superconducting linear accelerator
journal, May 2020
- Decking, W.; Abeghyan, S.; Abramian, P.
- Nature Photonics, Vol. 14, Issue 6
Scattering off molecules far from equilibrium
journal, August 2019
- Yong, Haiwang; Ruddock, Jennifer M.; Stankus, Brian
- The Journal of Chemical Physics, Vol. 151, Issue 8
Reconstruction of three-dimensional molecular structure from diffraction of laser-aligned molecules
journal, July 2014
- Yang, Jie; Makhija, Varun; Kumarappan, Vinod
- Structural Dynamics, Vol. 1, Issue 4
Electron Diffraction and Molecular Structure
journal, August 1933
- Dornte, Ralph W.
- The Journal of Chemical Physics, Vol. 1, Issue 8
Coherence in nonradiative transitions: internal conversion in Rydberg-excited N-methyl and N-ethyl morpholine
journal, January 2017
- Zhang, Yao; Jónsson, Hannes; Weber, Peter M.
- Phys. Chem. Chem. Phys., Vol. 19, Issue 38
Structural Dynamics in Floppy Systems: Ultrafast Conformeric Motions in Rydberg-Excited Triethylamine
journal, March 2011
- Deb, Sanghamitra; Bayes, Brian A.; Minitti, Michael P.
- The Journal of Physical Chemistry A, Vol. 115, Issue 10
Atomformfaktorbestimmung mit Elektronen
journal, November 1930
- Mark, H.; Wierl, R.
- Zeitschrift f�r Physik, Vol. 60, Issue 11-12
Diffractive Imaging of Coherent Nuclear Motion in Isolated Molecules
journal, October 2016
- Yang, Jie; Guehr, Markus; Shen, Xiaozhe
- Physical Review Letters, Vol. 117, Issue 15
Observation of Structural Wavepacket Motion: The Umbrella Mode in Rydberg-Excited N -Methyl Morpholine
journal, July 2017
- Zhang, Yao; Deb, Sanghamitra; Jónsson, Hannes
- The Journal of Physical Chemistry Letters, Vol. 8, Issue 16
Electronic Spectroscopy and Ultrafast Energy Relaxation Pathways in the Lowest Rydberg States of Trimethylamine
journal, October 2008
- Cardoza, Job D.; Rudakov, Fedor M.; Weber, Peter M.
- The Journal of Physical Chemistry A, Vol. 112, Issue 43
Ultrafast x-ray and electron scattering of free molecules: A comparative evaluation
journal, May 2020
- Ma, Lingyu; Yong, Haiwang; Geiser, Joseph D.
- Structural Dynamics, Vol. 7, Issue 3