Helium tagging infrared photodissociation spectroscopy of reactive ions
J Roithová, A Gray, E Andris, J Jasik… - Accounts of Chemical …, 2016 - ACS Publications
Conspectus The interrogation of reaction intermediates is key for understanding chemical
reactions; however their direct observation and study remains a considerable challenge …
reactions; however their direct observation and study remains a considerable challenge …
Glycan analysis by ion mobility-mass spectrometry and gas-phase spectroscopy
Highlights•Ion mobility-mass spectrometry (IM-MS) based methods can be used to elucidate
complex glycans.•IM-MS enables coarse separation of molecular classes and rapid …
complex glycans.•IM-MS enables coarse separation of molecular classes and rapid …
Cryogenic ion trap vibrational spectroscopy of hydrogen-bonded clusters relevant to atmospheric chemistry
Recent advances in the gas phase vibrational spectroscopy of mass-selected ions are
described, highlighting experiments on hydrogen-bonded (HBed) clusters relevant to …
described, highlighting experiments on hydrogen-bonded (HBed) clusters relevant to …
Identification of active sites and structural characterization of reactive ionic intermediates by cryogenic ion trap vibrational spectroscopy
Cryogenic ion trap vibrational spectroscopy paired with quantum chemistry currently
represents the most generally applicable approach for the structural investigation of …
represents the most generally applicable approach for the structural investigation of …
Snapshots of proton accommodation at a microscopic water surface: Understanding the vibrational spectral signatures of the charge defect in cryogenically cooled H+ …
JA Fournier, CT Wolke, MA Johnson… - The Journal of …, 2015 - ACS Publications
We review the role that gas-phase, size-selected protonated water clusters, H+ (H2O) n,
have played in unraveling the microscopic mechanics responsible for the spectroscopic …
have played in unraveling the microscopic mechanics responsible for the spectroscopic …
Single molecule infrared spectroscopy in the gas phase
A Calvin, S Eierman, Z Peng, M Brzeczek… - Nature, 2023 - nature.com
Spectroscopy is a key analytical tool that provides valuable insight into molecular structure
and is widely used to identify chemical samples. Tagging spectroscopy is a form of action …
and is widely used to identify chemical samples. Tagging spectroscopy is a form of action …
Efficient anharmonic vibrational spectroscopy for large molecules using local-mode coordinates
This article presents a general computational approach for efficient simulations of
anharmonic vibrational spectra in chemical systems. An automated local-mode vibrational …
anharmonic vibrational spectra in chemical systems. An automated local-mode vibrational …
The Hydrated Excess Proton in the Zundel Cation H5O2+: The Role of Ultrafast Solvent Fluctuations
The nature of the excess proton in liquid water has remained elusive after decades of
extensive research. In view of ultrafast structural fluctuations of bulk water scrambling the …
extensive research. In view of ultrafast structural fluctuations of bulk water scrambling the …
State-resolved infrared spectrum of the protonated water dimer: revisiting the characteristic proton transfer doublet peak
The infrared (IR) spectra of protonated water clusters encode precise information on the
dynamics and structure of the hydrated proton. However, the strong anharmonic coupling …
dynamics and structure of the hydrated proton. However, the strong anharmonic coupling …
Cold ion spectroscopy for structural identifications of biomolecules
OV Boyarkin - International Reviews in Physical Chemistry, 2018 - Taylor & Francis
Over the last decade, the spectroscopy of cryogenically cold ions isolated in the gas phase
has been developed as a new tool for structural elucidations of biological molecules …
has been developed as a new tool for structural elucidations of biological molecules …