100 citations · 109 across the 2 of their papers we have counts for
3 papers
Dynamic Chemical Model for H2/O2 Combustion Developed Through a Community Workflow
James Oreluk, Craig D. Needham, Sathya Baskaran +5
Elementary-reaction models for H2/O2 combustion were evaluated and optimized through a collaborative workflow, establishing accuracy and characterizing uncertainties. Quantitative…
Assessing impacts of discrepancies in model parameters on autoignition model performance: a case study using butanol
Sai Krishna Sirumalla, Morgan A. Mayer, Kyle E. Niemeyer +1
Side-by-side comparison of detailed kinetic models using a new tool to aid recognition of species structures reveals significant discrepancies in the published rates of many reacti…
Automated transition state theory calculations for high-throughput kinetics
Pierre L. Bhoorasingh, Belinda L. Slakman, Fariba Seyedzadeh Khanshan +2
A scarcity of known chemical kinetic parameters leads to the use of many reaction rate estimates, which are not always sufficiently accurate, in the construction of detailed kineti…