Capturing chemistry in action with electrons: realization of atomically resolved reaction dynamics
AA Ischenko, PM Weber, RJD Miller - Chemical reviews, 2017 - ACS Publications
One of the grand challenges in chemistry has been to directly observe atomic motions
during chemical processes. The depiction of the nuclear configurations in space-time to …
during chemical processes. The depiction of the nuclear configurations in space-time to …
Ultrafast X-ray transient absorption spectroscopy of gas-phase photochemical reactions: A new universal probe of photoinduced molecular dynamics
A Bhattacherjee, SR Leone - Accounts of chemical research, 2018 - ACS Publications
Conspectus Time-resolved spectroscopic investigations of light-induced chemical reactions
with universal detection capitalize recently on single-photon molecular probing using laser …
with universal detection capitalize recently on single-photon molecular probing using laser …
Femtosecond x-ray spectroscopy of an electrocyclic ring-opening reaction
The ultrafast light-activated electrocyclic ring-opening reaction of 1, 3-cyclohexadiene is a
fundamental prototype of photochemical pericyclic reactions. Generally, these reactions are …
fundamental prototype of photochemical pericyclic reactions. Generally, these reactions are …
The photochemical ring-opening of 1, 3-cyclohexadiene imaged by ultrafast electron diffraction
The ultrafast photoinduced ring-opening of 1, 3-cyclohexadiene constitutes a textbook
example of electrocyclic reactions in organic chemistry and a model for photobiological …
example of electrocyclic reactions in organic chemistry and a model for photobiological …
Observation of the molecular response to light upon photoexcitation
When a molecule interacts with light, its electrons can absorb energy from the
electromagnetic field by rapidly rearranging their positions. This constitutes the first step of …
electromagnetic field by rapidly rearranging their positions. This constitutes the first step of …
Ultrafast photoinduced dynamics of 1, 3-cyclohexadiene using XMS-CASPT2 surface hopping
I Polyak, L Hutton, R Crespo-Otero… - Journal of chemical …, 2019 - ACS Publications
A full-dimensional simulation of the photodissociation of 1, 3-cyclohexadiene in the manifold
of three electronic states was performed via nonadiabatic surface hopping dynamics using …
of three electronic states was performed via nonadiabatic surface hopping dynamics using …
Ultrafast intersystem crossing in acetylacetone via femtosecond X-ray transient absorption at the carbon K-edge
A Bhattacherjee, CD Pemmaraju… - Journal of the …, 2017 - ACS Publications
Molecular triplet states constitute a crucial gateway in the photochemical reactions of
organic molecules by serving as a reservoir for the excess electronic energy. Here, we …
organic molecules by serving as a reservoir for the excess electronic energy. Here, we …
On electron pair rearrangements in photochemical reactions: 1, 3-cyclohexadiene ring opening
C Guerra, L Ayarde-Henríquez… - The Journal of …, 2021 - ACS Publications
1, 3-Cyclohexadiene ring opening has been studied within the bonding evolution theory
(BET) framework. We have focused on describing for the first time the electron pair …
(BET) framework. We have focused on describing for the first time the electron pair …
[HTML][HTML] Ultrafast x-ray and electron scattering of free molecules: A comparative evaluation
Resolving gas phase molecular motions with simultaneous spatial and temporal resolution
is rapidly coming within the reach of x-ray Free Electron Lasers (XFELs) and Mega-electron …
is rapidly coming within the reach of x-ray Free Electron Lasers (XFELs) and Mega-electron …
Nonadiabatic dynamics of 1, 3-cyclohexadiene by curvature-driven coherent switching with decay of mixing
The photoinduced ring-opening reaction of 1, 3-cyclohexadiene to produce 1, 3, 5-
hexatriene is a classic electrocyclic reaction and is also a prototype for many reactions of …
hexatriene is a classic electrocyclic reaction and is also a prototype for many reactions of …