Automated reaction kinetics of gas-phase organic species over multiwell potential energy surfaces
Automation of rate-coefficient calculations for gas-phase organic species became possible
in recent years and has transformed how we explore these complicated systems …
in recent years and has transformed how we explore these complicated systems …
Insights into constraining rate coefficients in fuel oxidation mechanisms using genetic algorithm optimization
Accurate fuel oxidation mechanisms can enable predictive capabilities that aid in advancing
combustion technologies. High-level computational kinetics can yield reasonable rate …
combustion technologies. High-level computational kinetics can yield reasonable rate …
Complete reactants-to-products observation of a gas-phase chemical reaction with broad, fast mid-infrared frequency combs
Molecular diagnostics are a primary tool of modern chemistry, enabling researchers to map
chemical reaction pathways and rates to better design and control chemical systems. Many …
chemical reaction pathways and rates to better design and control chemical systems. Many …
GHz repetition rate mid-infrared frequency comb spectroscopy of fast chemical reactions
Molecular diagnostics are a primary tool of modern chemistry, enabling researchers to map
chemical reaction pathways and rates to better design and control chemical systems. Many …
chemical reaction pathways and rates to better design and control chemical systems. Many …
Time-resolved quantification of key species and mechanistic insights in low-temperature tetrahydrofuran oxidation
We investigate the kinetics and report the time-resolved concentrations of key chemical
species in the oxidation of tetrahydrofuran (THF) at 7500 torr and 450–675 K. Experiments …
species in the oxidation of tetrahydrofuran (THF) at 7500 torr and 450–675 K. Experiments …
New Instrument for Time-Resolved OH and HO2 Quantification in High-Pressure Laboratory Kinetics Studies
L Sheps, K Au - The Journal of Physical Chemistry A, 2024 - ACS Publications
We have constructed a new time-resolved high-pressure fluorescence assay by gas
expansion (HP-FAGE) apparatus, optimized for the detection of OH and HO2 radicals in …
expansion (HP-FAGE) apparatus, optimized for the detection of OH and HO2 radicals in …
Probing O2-dependence of cyclopentyl reactions via isomer-resolved speciation
AW Hill, DA Moore, NS Dewey, SW Hartness… - Proceedings of the …, 2024 - Elsevier
Modeling chemical kinetics relevant to low-temperature combustion requires complete
description of reactions involving critical species such as hydroperoxyalkyl radicals, Q˙ OOH …
description of reactions involving critical species such as hydroperoxyalkyl radicals, Q˙ OOH …
Enabling High-Temperature Measurements with Frequency Comb Laser and Spectral Database Development
SC Egbert - 2024 - search.proquest.com
From characterizing hypersonic combustion to monitoring urban air quality, absorption
spectroscopy is a powerful optical diagnostic that can non-intrusively measure velocity …
spectroscopy is a powerful optical diagnostic that can non-intrusively measure velocity …