Predicting critical properties and acentric factors of fluids using multitask machine learning
Knowledge of critical properties, such as critical temperature, pressure, density, as well as
acentric factor, is essential to calculate thermo-physical properties of chemical compounds …
acentric factor, is essential to calculate thermo-physical properties of chemical compounds …
Evaluating the thermal stability of chemicals and systems: A review
In the realm of chemical processing, particularly at the industrial scale, safety is of utmost
importance. A predominant factor causing accidents within the chemical industry is runaway …
importance. A predominant factor causing accidents within the chemical industry is runaway …
Soot particle morphology and polycyclic aromatic hydrocarbons formation molecular dynamics during diffusion combustion of three pentanol biofuels
Y Hua, D Gao, S Meng, Y Zhang - Science of The Total Environment, 2024 - Elsevier
Soot particles constitute a major pollutant in engine diffusion combustion, posing a serious
threat to human health and the atmospheric environment. The employment of carbon-neutral …
threat to human health and the atmospheric environment. The employment of carbon-neutral …
Empirical Modeling of Synthetic Fuel Combustion in a Small Turbofan
Drop-in fuels for aviation gas-turbine engines have been introduced recently to mitigate
global warming. Despite their similarity to the fossil fuel Jet A-1, their combustion in …
global warming. Despite their similarity to the fossil fuel Jet A-1, their combustion in …
Theoretical study on iso‐pentanol oxidation chemistry: Fuel radical isomerization and decomposition kinetics and mechanism development
This study undertakes a detailed theoretical investigation into the iso‐pentanol radical
isomerization and decomposition kinetics and the mechanism development of the iso …
isomerization and decomposition kinetics and the mechanism development of the iso …
Theoretical Study on Isomerization and Decomposition Kinetics of Iso-Pentanol Radicals
C Zhou, D Yaozong, Z Huang, D Han - Available at SSRN 4252470 - papers.ssrn.com
This study focuses on the iso-pentanol radical isomerization and decomposition kinetics
across a wide range of temperatures and pressures. The CCSD (T)/CBS//M08-HX/6-311+ G …
across a wide range of temperatures and pressures. The CCSD (T)/CBS//M08-HX/6-311+ G …