Ab initio simulations of complementary K-edges and solvatization effects for detection of proton transfer in aqueous 2-thiopyridone-Reference-Cited by-同舟云学术

Ab initio simulations of complementary K-edges and solvatization effects for detection of proton transfer in aqueous 2-thiopyridone

Published:2019-09-21 Issue:11 Volume:151 Page:114117
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Norell J.¹^ORCID,Eckert S.²^ORCID,Van Kuiken B. E.³^ORCID,Föhlisch A.²⁴^ORCID,Odelius M.¹^ORCID

Affiliation:

1. Department of Physics, AlbaNova University Center, Stockholm University, SE-106 91 Stockholm, Sweden

2. Institut für Physik und Astronomie, Universität Potsdam, Karl-Liebknecht-Str. 24/25, 14476 Potsdam, Germany

3. European XFEL, Holzkoppel 4, 22869 Schenefeld, Germany

4. Institute for Methods and Instrumentation for Synchrotron Radiation Research, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Albert-Einstein-Str. 15, 12489 Berlin, Germany

Funder

Vetenskapsrådet

Carl Tryggers Stiftelse för Vetenskaplig Forskning

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5109840

Reference58 articles.

1. The ultrafast X-ray spectroscopic revolution in chemical dynamics

2. Recent advances on ultrafast X-ray spectroscopy in the chemical sciences

3. Photoemission from Liquid Aqueous Solutions

4. Monitoring Ultrafast Chemical Dynamics by Time-Domain X-ray Photo- and Auger-Electron Spectroscopy

5. Soft X-ray Absorption Spectroscopy of Liquids and Solutions

Cited by 8 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Dissociation of Pyridinethiolate Ligands during Hydrogen Evolution Reactions of Ni-Based Catalysts: Evidence from X-ray Absorption Spectroscopy;Inorganic Chemistry;2022-06-22

2. Spectral Signatures of Ultrafast Excited-State Intramolecular Proton Transfer from Computational Multi-edge Transient X-ray Absorption Spectroscopy;The Journal of Physical Chemistry Letters;2021-10-04

3. How Hydrogen Bonding Amplifies Isomeric Differences in Pyridones toward Strong Changes in Acidity and Tautomerism;The Journal of Physical Chemistry B;2021-02-09

4. TD-DFT simulations of K-edge resonant inelastic X-ray scattering within the restricted subspace approximation;Physical Chemistry Chemical Physics;2021

5. From synchrotrons for XFELs: the soft x-ray near-edge spectrum of the ESCA molecule;Journal of Physics B: Atomic, Molecular and Optical Physics;2020-12-02