The analytical representation of electronic potential-energy surfaces
GC Schatz - Reviews of Modern Physics, 1989 - APS
This article reviews the commonly used methods for representing electronic potential-energy
surfaces for small molecules and simple chemical reactions in terms of globally defined …
surfaces for small molecules and simple chemical reactions in terms of globally defined …
Sulfur chemistry in the atmospheres of warm and hot Jupiters
We present and validate a new network of atmospheric thermochemical and photochemical
sulfur reactions. We use a 1D chemical kinetics model to investigate these reactions as part …
sulfur reactions. We use a 1D chemical kinetics model to investigate these reactions as part …
Quantitative detection of H 2 S and CS 2 mixed gases based on UV absorption spectrometry
H2S and CS2 are the decomposition components of insulating gas SF6. The detection of
these two gases is significant for the online monitoring and fault diagnosis of SF6 electrical …
these two gases is significant for the online monitoring and fault diagnosis of SF6 electrical …
UV absorption cross-sections of selected sulfur-containing compounds at temperatures up to 500 C
H Grosch, A Fateev, S Clausen - Journal of Quantitative Spectroscopy and …, 2015 - Elsevier
The temperature dependence of the ultraviolet absorption cross-sections of three different
sulfur containing compounds, hydrogen sulfide (H 2 S), carbon disulfide (CS 2) and carbonyl …
sulfur containing compounds, hydrogen sulfide (H 2 S), carbon disulfide (CS 2) and carbonyl …
Global potential energy surfaces for the lowest 1A′, 3A″, and 1A″ states of HNO
R Guadagnini, GC Schatz, SP Walch - The Journal of chemical physics, 1995 - pubs.aip.org
We present global ab initio potential energy surfaces for the three lowest energy 1 A′, 3 A
″, and 1 A ″surfaces of HNO. These surfaces are the lowest three states of the HNO and …
″, and 1 A ″surfaces of HNO. These surfaces are the lowest three states of the HNO and …
On the UV photodissociation dynamics of hydrogen iodide
The near ultraviolet photodissociation of hydrogen iodide has been investigated in detail
using the technique of H Rydberg atom photofragment translational spectroscopy …
using the technique of H Rydberg atom photofragment translational spectroscopy …
Supercollisions of fast H-atom with ethylene on an accurate full-dimensional potential energy surface
YL Fu, X Lu, YC Han, B Fu, DH Zhang - The Journal of Chemical …, 2021 - pubs.aip.org
The collisions transferring large portions of energy are often called supercollisions. In the H+
C 2 H 2 reactive system, the rovibrationally cold C 2 H 2 molecule can be activated with …
C 2 H 2 reactive system, the rovibrationally cold C 2 H 2 molecule can be activated with …
The infinite‐order sudden approximation for collisions involving molecules in Π electronic states: A new derivation and calculations of rotationally inelastic cross …
GC Corey, MH Alexander - The Journal of chemical physics, 1986 - pubs.aip.org
A new derivation is presented of the infinite‐order sudden (IOS) approximation for
rotationally inelastic collisions of a diatomic molecule in a Π electronic state with a closed …
rotationally inelastic collisions of a diatomic molecule in a Π electronic state with a closed …
On the ultraviolet photofragmentation of hydrogen iodide
AB Alekseyev, HP Liebermann, DB Kokh… - The Journal of …, 2000 - pubs.aip.org
Using JCP format Page 1 On the ultraviolet photofragmentation of hydrogen iodide Aleksey B.
Alekseyev,a) Heinz-Peter Liebermann, Daria B. Kokh, and Robert J. Buenker Bergische …
Alekseyev,a) Heinz-Peter Liebermann, Daria B. Kokh, and Robert J. Buenker Bergische …
Chemical activation through super energy transfer collisions
Can a molecule be efficiently activated with a large amount of energy in a single collision
with a fast atom? If so, this type of collision will greatly affect molecular reactivity and …
with a fast atom? If so, this type of collision will greatly affect molecular reactivity and …