Katrín Blöndal

John Brown University — United States

Materials Science · Physical Sciences

10h-index725citations32works0.02yr avg
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Research Topics

Catalytic Processes in Materials Science(14), Machine Learning in Materials Science(13), Catalysis and Oxidation Reactions(11), Catalysts for Methane Reforming(7), Advanced Chemical Physics Studies(6)

Publications32 total

Automatic mechanism generation involving kinetics of surface reactions with bidentate adsorbates
Digital Discovery·2023· 7 citedOpen Access
Author response for "Automatic mechanism generation involving kinetics of surface reactions with bidentate adsorbates"
2023
Data for Automatic Mechanism Generation Involving Kinetics of Surface Reactions with Bidentate Adsorbates
Zenodo (CERN European Organization for Nuclear Research)·2023Open Access
Data for Automatic Mechanism Generation Involving Kinetics of Surface Reactions with Bidentate Adsorbates
2023· 2 citedOpen Access
Configuration Space Integration for Adsorbate Partition Functions: The Effect of Anharmonicity on the Thermophysical Properties of CO–Pt(111) and CH<sub>3</sub>OH–Cu(111)
ACS Catalysis·2022· 12 citedOpen Access
RMG Database for Chemical Property Prediction
Journal of Chemical Information and Modeling·2022· 134 citedOpen Access
Detailed Microkinetics for the Oxidation of Exhaust Gas Emissions through Automated Mechanism Generation
ACS Catalysis·2022· 30 cited
Detailed microkinetics for the oxidation of exhaust gas emissions through automated mechanism generation
2022· 1 citedOpen Access
Patients' expectations and experiences of provided surgery‐related patient education: A descriptive longitudinal study
Nursing Open·2022· 38 citedOpen Access
Including Anharmonicity in Adsorbate Partition Functions: Effect on the Thermodynamic Properties of Carbon Monoxide on Pt(111) and Methanol on Cu(111).
2022Open Access
Application of a Novel Saddle Point Optimization Algorithm on Surface Reactions Involving Bidentate Adsorbates.
2021Open Access
Adsorbate Partition Functions via Phase Space Integration: Quantifying the Effect of Translational Anharmonicity on Thermodynamic Properties
The Journal of Physical Chemistry C·2021· 15 citedOpen Access
Adsorbate Partition Functions via Phase Space Integration: Quantifying the Effect of Translational Anharmonicity on Thermodynamic Properties.
2021· 1 citedOpen Access
Quantifying the Impact of Parametric Uncertainty on Automatic Mechanism Generation for CO <sub>2</sub> Hydrogenation on Ni(111)
JACS Au·2021· 53 citedOpen Access
Data for Quantifying the Impact of Parametric Uncertainty on Automatic Mechanism Generation for CO2 Hydrogenation on Ni(111)
Zenodo (CERN European Organization for Nuclear Research)·2021Open Access
Data for Quantifying the Impact of Parametric Uncertainty on Automatic Mechanism Generation for CO2 Hydrogenation on Ni(111)
Zenodo (CERN European Organization for Nuclear Research)·2021· 1 citedOpen Access
Automated Mechanism Generation Using Linear Scaling Relationships and Sensitivity Analyses Applied to Catalytic Partial Oxidation of Methane
ACS Catalysis·2021· 40 citedOpen Access
Reaction Mechanism Generator v3.0: Advances in Automatic Mechanism Generation
Journal of Chemical Information and Modeling·2021· 265 citedOpen Access
Automated Mechanism Generation Using Linear Scaling Relationships and Sensitivity Analyses Applied to Catalytic Partial Oxidation of Methane
2021· 1 citedOpen Access
Quantifying the Impact of Parametric Uncertainty on Automatic Mechanism Generation for CO2 Hydrogenation on Ni(111)
2021· 4 citedOpen Access
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Frequent Co-authors

Richard H. West(24), C. Franklin Goldsmith(21), Emily Mazeau(18), Bjarne Kreitz(13), Khachik Sargsyan(12), Franklin Goldsmith(8), Gregor D. Wehinger(6), Thomas Turek(6), Priyanka Satpute(6), David H. Bross(5), Mengjie Liu(4), Alon Grinberg Dana(4), Matthew S. Johnson(4), A. Mark Payne(4), Colin A. Grambow(4), Nathan W. Yee(4), William H. Green(4), Kirk Badger(4), Agnes Jocher(3), Kehang Han(3)