Photoelectron spectroscopy in molecular physical chemistry
I Fischer, ST Pratt - Physical Chemistry Chemical Physics, 2022 - pubs.rsc.org
Photoelectron spectroscopy has long been a powerful method in the toolbox of experimental
physical chemistry and molecular physics. Recent improvements in coincidence methods …
physical chemistry and molecular physics. Recent improvements in coincidence methods …
Exceptionally long covalent CC bonds—A local vibrational mode study
AAA Delgado, A Humason, R Kalescky, M Freindorf… - Molecules, 2021 - mdpi.com
For decades one has strived to synthesize a compound with the longest covalent C− C bond
applying predominantly steric hindrance and/or strain to achieve this goal. On the other …
applying predominantly steric hindrance and/or strain to achieve this goal. On the other …
[HTML][HTML] Infrared spectroscopy of ions and ionic clusters upon ionization of ethane in helium droplets
Helium droplets are unique hosts for isolating diverse molecular ions for infrared
spectroscopic experiments. Recently, it was found that electron impact ionization of ethylene …
spectroscopic experiments. Recently, it was found that electron impact ionization of ethylene …
Photoinduced C–H bond fission in prototypical organic molecules and radicals
Recent experimental and computational advances have heralded huge progress in the
range and the detail of the database pertaining to photoinduced C–H bond fission …
range and the detail of the database pertaining to photoinduced C–H bond fission …
Ammonia Borane, NH3BH3: A Threshold Photoelectron–Photoion Coincidence Study of a Potential Hydrogen‐Storage Material
D Schleier, M Gerlach… - … A European Journal, 2022 - Wiley Online Library
We have investigated the photoionization of ammonia borane (AB) and determined
adiabatic ionization energy to be 9.26±0.03 eV for the X+ 2E← X 1A1 transition. Although …
adiabatic ionization energy to be 9.26±0.03 eV for the X+ 2E← X 1A1 transition. Although …
Ultraviolet photochemistry of ethane: implications for the atmospheric chemistry of the gas giants
Chemical processing in the stratospheres of the gas giants is driven by incident vacuum
ultraviolet (VUV) light. Ethane is an important constituent in the atmospheres of the gas …
ultraviolet (VUV) light. Ethane is an important constituent in the atmospheres of the gas …
Unexpected reversal of stability in strained systems containing one-electron bonds
F Fantuzzi, W Wolff, HM Quitián-Lara… - Physical Chemistry …, 2019 - pubs.rsc.org
Ring strain energy is a very well documented feature of neutral cycloalkanes, and influences
their structural, thermochemical and reactivity properties. In this work, we apply density …
their structural, thermochemical and reactivity properties. In this work, we apply density …
Precise determination of adiabatic ionisation energies of large polyatomic molecules: p-diaminobenzene
JR Schmitz, U Hollenstein, F Merkt - Molecular Physics, 2023 - Taylor & Francis
We present a procedure, based on established principles, to accurately determine the
ionisation energies of medium-sized to large polyatomic molecules in supersonic beams …
ionisation energies of medium-sized to large polyatomic molecules in supersonic beams …
Important components for accurate hyperfine coupling constants: electron correlation, dynamic contributions, and solvation effects
S Vogler, JCB Dietschreit, LDM Peters… - Molecular …, 2020 - Taylor & Francis
The calculation of hyperfine coupling constants is a challenging task in balancing accuracy
and computational effort. While previous work has shown the importance of electron …
and computational effort. While previous work has shown the importance of electron …
STARGATE: A new instrument for high-resolution photodissociation spectroscopy of cold ionic species
Spectroscopy of transient anions and radicals by gated and accelerated time-of-flight
experiment is a new spectrometer developed in UCLouvain. This instrument measures high …
experiment is a new spectrometer developed in UCLouvain. This instrument measures high …