Search Results - "Kunz, M. Ross"

Pulse response analysis using the Y-procedure: A data science approach by Ross Kunz, M., Borders, Tammie, Redekop, Evgeniy, Yablonsky, Gregory S., Constales, Denis, Wang, Lucun, Fushimi, Rebecca

“…•A detailed workflow for analysis of transient kinetic pulse response data is presented.•Implementation of the Y-Procedure for dynamic rate/concentration…”
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Model Updating for Spectral Calibration Maintenance and Transfer Using 1-Norm Variants of Tikhonov Regularization by Kunz, M. Ross, Kalivas, John H, Andries, Erik

“…In this study, calibration maintenance confronts the problem of updating a model developed in the primary condition to accurately predict the calibrated…”
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Multivariate calibration maintenance and transfer through robust fused LASSO by Ross Kunz, M., She, Yiyuan

“…This article studies calibration maintenance and transfer to build a statistical model that is able to predict analyte concentrations by a set of spectra…”
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Transient Kinetic Experiments within the High Conversion Domain: The Case of Ammonia Decomposition by Yixiao Wang, M. Ross Kunz, Skyler Siebers, Harry Rollins, John Gleaves, Gregory Yablonsky, Rebecca Fushimi

“…In the development of catalytic materials, a set of standard conditions is needed where the kinetic performance of many samples can be compared. This can be…”
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Extracting Knowledge from Data through Catalysis Informatics by Medford, Andrew J, Kunz, M. Ross, Ewing, Sarah M, Borders, Tammie, Fushimi, Rebecca

“…Catalysis informatics is a distinct subfield that lies at the intersection of cheminformatics and materials informatics but with distinctive challenges arising…”
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Formation of Surface Impurities on Lithium–Nickel–Manganese–Cobalt Oxides in the Presence of CO2 and H2O by Fang, Zongtang, Confer, Matthew P, Wang, Yixiao, Wang, Qiang, Kunz, M. Ross, Dufek, Eric J, Liaw, Boryann, Klein, Tonya M, Dixon, David A, Fushimi, Rebecca

“…Surface impurities involving parasitic reactions and gas evolution contribute to the degradation of high Ni content LiNi x Mn y Co z O2 (NMC) cathode…”
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Rate/Concentration Kinetic Petals: A Transient Method to Examine the Interplay of Surface Reaction Processes by Wang, Yixiao, Kunz, M. Ross, Constales, Denis, Yablonsky, Gregory, Fushimi, Rebecca

“…Transient pulse response experiments are used to construct rate/concentration kinetic dependencies, RC Petals and provide a new method to distinguish the…”
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Correlated synthetic time series generation for energy system simulations using Fourier and ARMA signal processing by Talbot, Paul W., Rabiti, Cristian, Alfonsi, Andrea, Krome, Cameron, Kunz, M. Ross, Epiney, Aaron, Wang, Congjian, Mandelli, Diego

“…Summary As the contribution of renewable energy grows in electricity markets, the complexity of the energy mix required to meet demand grows, likewise the need…”
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Integrating atomistic simulations and machine learning to design multi-principal element alloys with superior elastic modulus by Grant, Michael, Kunz, M. Ross, Iyer, Krithika, Held, Leander I., Tasdizen, Tolga, Aguiar, Jeffery A., Dholabhai, Pratik P.

“…Multi-principal element, high entropy alloys (HEAs) are an emerging class of materials that have found applications across the board. Owing to the multitude of…”
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Understanding Reaction Networks through Controlled Approach to Equilibrium Experiments Using Transient Methods by Wang, Yixiao, Qian, Jin, Fang, Zongtang, Kunz, M. Ross, Yablonsky, Gregory, Fortunelli, Alessandro, Goddard III, William A, Fushimi, Rebecca R

“…We report a combined experimental/theoretical approach to studying heterogeneous gas/solid catalytic processes using low-pressure pulse response experiments…”
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Quantifying the impact of temporal analysis of products reactor initial state uncertainties on kinetic parameters by Yonge, Adam, Gusmão, Gabriel S., Batchu, Rakesh, Kunz, M. Ross, Fang, Zongtang, Fushimi, Rebecca, Medford, Andrew J.

“…The temporal analysis of products (TAP) reactor provides a route to extract intrinsic kinetics from transient measurements. Current TAP uncertainty…”
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Recent progress toward catalyst properties, performance, and prediction with data-driven methods by Chen, Yu-Yen, Ross Kunz, M., He, Xiaolong, Fushimi, Rebecca

“…Data-driven approaches are currently renovating the field of heterogenous catalysis and open the door to advance catalyst design. Their success depends heavily…”
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Investigating the Efficacy of Integrating Energy Crops into Non-Profitable Subfields in Iowa by Nair, Shyam K., Griffel, L. Michael, Hartley, Damon S., McNunn, Gabe S., Kunz, M. Ross

“…Within-field spatial variability reduces growers’ return on investment and overall productivity while potentially increasing negative environmental impacts…”
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Autonomous control of heat pipes through digital twins: Application to fission batteries by Wilsdon, Katherine, Hansel, Joshua, Kunz, M. Ross, Browning, Jeren

“…Fission batteries are envisioned as nuclear energy systems and associated technology that can be fully utilized in a battery-like operation, where the system…”
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TAPsolver: A Python package for the simulation and analysis of TAP reactor experiments by Yonge, Adam, Kunz, M. Ross, Batchu, Rakesh, Fang, Zongtang, Issac, Tobin, Fushimi, Rebecca, Medford, Andrew J.

“…•An open-source framework for simulation and fitting of micro-kinetic models to TAP data.•Code is used to extract kinetic parameters from experimental CO…”
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Mechanistic pathways and role of oxygen in oxidative coupling of methane derived from transient kinetic studies by Wang, Yixiao, Wang, Bingwen, Sourav, Sagar, Batchu, Rakesh, Fang, Zongtang, Kunz, M. Ross, Yablonsky, Gregory, Nikolla, Eranda, Fushimi, Rebecca

“…Oxidative coupling of methane (OCM) is a promising industrial process to upgrade natural gas to high value chemicals. In this study, Temporal Analysis of…”
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Data driven reaction mechanism estimation via transient kinetics and machine learning by Kunz, M. Ross, Yonge, Adam, Fang, Zongtang, Batchu, Rakesh, Medford, Andrew J., Constales, Denis, Yablonsky, Gregory, Fushimi, Rebecca

“…•Reaction mechanism characterization via experimental transient kinetic measurements.•Integration of well-defined reactor physics and machine…”
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A machine learning framework for early detection of lithium plating combining multiple physics-based electrochemical signatures by Chen, Bor-Rong, Kunz, M. Ross, Tanim, Tanvir R., Dufek, Eric J.

“…A key challenge for lithium (Li)-ion batteries is the capability to manage battery performance and predict lifetime. Early detection of battery-aging phenomena…”
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Accumulation Dynamics as a New Tool for Catalyst Discrimination: An Example from Ammonia Decomposition by Wang, Yixiao, Kunz, M. Ross, Fang, Zongtang, Yablonsky, Gregory, Fushimi, Rebecca

“…Transient kinetic experiments were used to investigate the microkinetic model of ammonia decomposition over iron, cobalt, and a bimetallic preparation of the…”
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Probability theory for inverse diffusion: Extracting the transport/kinetic time-dependence from transient experiments by Kunz, M. Ross, Batchu, Rakesh, Wang, Yixiao, Fang, Zongtang, Yablonsky, Gregory, Constales, Denis, Pittman, James, Fushimi, Rebecca

“…•A new inverse diffusion method for calculating time-dependent rate and concentration.•Transient rate/concentration are reconstructed from reactor exit flux to…”
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