Mitchell C. Groenenboom - Publications

2013-2018 University of Pittsburgh, Pittsburgh, PA, United States 
 2018- National Institute of Standards and Technology, Gaithersburg, MD, United States 

9 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Groenenboom MC, Anderson RM, Wollmershauser JA, Horton DJ, Policastro SA, Keith JA. Combined Neural Network Potential and Density Functional Theory Study of TiAl2O5 Surface Morphology and Oxygen Reduction Reaction Overpotentials Journal of Physical Chemistry C. 124: 15171-15179. DOI: 10.1021/Acs.Jpcc.0C02093  0.566
2019 Basdogan Y, Groenenboom MC, Henderson E, De S, Rempe SB, Keith JA. Machine Learning Guided Approach for Studying Solvation Environments. Journal of Chemical Theory and Computation. PMID 31809056 DOI: 10.1021/Acs.Jctc.9B00605  0.639
2017 Groenenboom MC, Keith JA. Quantum Chemical Analyses of BH4(-) and BH3 OH(-) Hydride Transfers to CO2 in Aqueous Solution with Potentials of Mean Force. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. PMID 28766822 DOI: 10.1002/Cphc.201700608  0.657
2017 Groenenboom MC, Anderson RM, Horton DJ, Basdogan Y, Roeper DF, Policastro SA, Keith JA. Doped Amorphous Ti Oxides To Deoptimize Oxygen Reduction Reaction Catalysis The Journal of Physical Chemistry C. 121: 16825-16830. DOI: 10.1021/Acs.Jpcc.7B04210  0.639
2017 Groenenboom MC, Keith JA. Front Cover: Quantum Chemical Analyses of BH4− and BH3OH− Hydride Transfers to CO2 in Aqueous Solution with Potentials of Mean Force (ChemPhysChem 22/2017) Chemphyschem. 18: 3084-3084. DOI: 10.1002/Cphc.201701162  0.615
2016 Groenenboom MC, Keith JA. Explicitly Unraveling the Roles of Counter Ions, Solvent Molecules, and Electron Correlation in Solution Phase Reaction Pathways. The Journal of Physical Chemistry. B. PMID 27662237 DOI: 10.1021/Acs.Jpcb.6B07606  0.677
2016 Groenenboom MC, Saravanan K, Zhu Y, Carr JM, Marjolin A, Faura GG, Yu EC, Dominey RN, Keith JA. Structural and Substituent Group Effects on Multielectron Standard Reduction Potentials of Aromatic N-Heterocycles. The Journal of Physical Chemistry. A. PMID 27529793 DOI: 10.1021/Acs.Jpca.6B07291  0.593
2016 Boes JR, Groenenboom MC, Keith JA, Kitchin JR. Neural network and ReaxFF comparison for Au properties International Journal of Quantum Chemistry. DOI: 10.1002/Qua.25115  0.574
2015 Grice KA, Groenenboom MC, Manuel JDA, Sovereign MA, Keith JA. Examining the selectivity of borohydride for carbon dioxide and bicarbonate reduction in protic conditions Fuel. 150: 139-145. DOI: 10.1016/J.Fuel.2015.02.007  0.609
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