activity
20162023
most citedOn the importance of graph search algorithms for DRGEP-based mechanism reduction methods

110 citations · 240 across the 8 of their papers we have counts for

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Showing physics.chem-phShow all

6 papers · 1 filter

physics.chem-ph2018

FACE gasoline surrogates formulated by an enhanced multivariate optimization framework

Shane R. Daly, Kyle E. Niemeyer, William J. Cannella +1

Design and optimization of higher efficiency, lower-emission internal combustion engines are highly dependent on fuel chemistry. Resolving chemistry for complex fuels, like gasolin…

physics.chem-ph2018

An automated target species selection method for dynamic adaptive chemistry simulations

Nicholas Curtis, Kyle Niemeyer, Chih-Jen Sung

The relative importance index (RII) method for determining appropriate target species for dynamic adaptive chemistry (DAC) simulations using the DRGEP method is developed. The accu…

physics.chem-ph20179 cited

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…

physics.chem-ph201720 cited

Reduced chemistry for butanol isomers at engine-relevant conditions

Xin Hui, Kyle E. Niemeyer, Kyle B. Brady +1

Butanol has received significant research attention as a second-generation biofuel in the past few years. In the present study, skeletal mechanisms for four butanol isomers were ge…

physics.chem-ph201728 cited

ChemKED: a human- and machine-readable data standard for chemical kinetics experiments

Bryan W. Weber, Kyle E. Niemeyer

Fundamental experimental measurements of quantities such as ignition delay times, laminar flame speeds, and species profiles (among others) serve important roles in understanding f…

physics.chem-ph201665 cited

Predicting fuel research octane number using Fourier-transform infrared absorption spectra of neat hydrocarbons

Shane R. Daly, Kyle E. Niemeyer, William J. Cannella +1

Liquid transportation fuels require costly and time-consuming tests to characterize metrics, such as Research Octane Number (RON) for gasoline. If fuel sale restrictions requiring…