2 citations · 3 across the 4 of their papers we have counts for
4 papers
A Priori Calibration of Transient Kinetics Data via Machine Learning
M. Ross Kunz, Adam Yonge, Rakesh Batchu +5
The temporal analysis of products reactor provides a vast amount of transient kinetic information that may be used to describe a variety of chemical features including the residenc…
Data Driven Reaction Mechanism Estimation via Transient Kinetics and Machine Learning
M. Ross Kunz, Adam Yonge, Zongtang Fang +4
Understanding the set of elementary steps and kinetics in each reaction is extremely valuable to make informed decisions about creating the next generation of catalytic materials.…
TAPsolver: A Python package for the simulation and analysis of TAP reactor experiments
Adam Yonge, M. Ross Kunz, Rakesh Batchu +4
An open-source, Python-based Temporal Analysis of Products (TAP) reactor simulation and processing program is introduced. TAPsolver utilizes algorithmic differentiation for the cal…
Kinetic Expression for Optimal Catalyst Electronic Configuration: The Case of Ammonia Decomposition
Nigora Turaeva, Rebecca Fushimi, Gregory Yablonsky
A new steady-state kinetic model of ammonia decomposition is presented and analyzed regarding the electronic properties of metal catalysts. The model is based on the classical Temk…