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James Dean
James Dean
Computational Scientist, Exabyte.io
Dirección de correo verificada de pitt.edu
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Año
Unfolding adsorption on metal nanoparticles: Connecting stability with catalysis
J Dean, MG Taylor, G Mpourmpakis
Science advances 5 (9), eaax5101, 2019
922019
Computational investigation of CO2 electroreduction on tin oxide and predictions of Ti, V, Nb and Zr dopants for improved catalysis
JAK Karthikeyan Saravanan, Yasemin Basdogan, James Dean
Journal of Materials Chemistry A 5, 11756-11763, 2017
612017
Design of Copper‐Based Bimetallic Nanoparticles for Carbon Dioxide Adsorption and Activation
J Dean, Y Yang, N Austin, G Veser, G Mpourmpakis
ChemSusChem 11 (7), 1169-1178, 2018
382018
Predicting metal–support interactions in oxide-supported single-atom catalysts
K Tan, M Dixit, J Dean, G Mpourmpakis
Industrial & Engineering Chemistry Research 58 (44), 20236-20246, 2019
352019
Improving alkane dehydrogenation activity on γ-Al 2 O 3 through Ga doping
M Abdelgaid, J Dean, G Mpourmpakis
Catalysis science & technology 10 (21), 7194-7202, 2020
302020
Rapid prediction of bimetallic mixing behavior at the nanoscale
J Dean, MJ Cowan, J Estes, M Ramadan, G Mpourmpakis
ACS nano 14 (7), 8171-8180, 2020
292020
Interpretable machine learning for materials design
J Dean, M Scheffler, TAR Purcell, SV Barabash, R Bhowmik, T Bazhirov
Journal of Materials Research 38 (20), 4477-4496, 2023
162023
Designing stable bimetallic nanoclusters via an iterative two-step optimization approach
X Yin, NM Isenberg, CL Hanselman, JR Dean, G Mpourmpakis, ...
Molecular Systems Design & Engineering 6 (7), 545-557, 2021
92021
CuZrO 3: If it exists it should be a sandwich
J Dean, Y Yang, G Veser, G Mpourmpakis
Physical Chemistry Chemical Physics 23 (41), 23748-23757, 2021
22021
Interpretable Machine Learning for Materials Design
T Bazhirov, J Dean, R Bhowmik, S Barabash, M Scheffler, T Purcell
APS March Meeting Abstracts 2022, S47. 010, 2022
2022
Computational Design of Optimal Bimetallic Nanoparticles: Bridging Stability with Adsorption
JR Dean
University of Pittsburgh, 2021
2021
Orienteering in an Uncharted Chemical Space: Searching for an Optimal Bimetallic Nanocatalyst
J Dean, G Mpourmpakis
2020 Virtual AIChE Annual Meeting, 2020
2020
Generalized Adsorption Models on Metal Nanoparticles
J Dean, MG Taylor, G Mpourmpakis
2019 AIChE Annual Meeting, 2019
2019
Understanding Mixing Behavior of Bimetallic Nanoparticles through Genetic Algorithm Modeling
M Cowan, J Dean, G Mpourmpakis
2019 AIChE Annual Meeting, 2019
2019
Computational Prediction of the Structure and Catalytic Properties of Copper Zirconium Oxide
J Dean, G Mpourmpakis
2018 AIChE Annual Meeting, 2018
2018
Investigation of Stability Trends in Bimetallic Cu-Ag, Cu-Au, and Ag-Au Nanoparticles Via Bond-Centric Model
M Ramadan, J Estes, J Dean, G Mpourmpakis
2018 AIChE Annual Meeting, 2018
2018
Computer-aided bimetallic nanoparticle design for carbon dioxide adsorption and activation
J Dean, Y Yang, N Austin, G Veser, G Mpourmpakis
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 256, 2018
2018
Cover Feature: Design of Copper‐Based Bimetallic Nanoparticles for Carbon Dioxide Adsorption and Activation (ChemSusChem 7/2018)
J Dean, Y Yang, N Austin, G Veser, G Mpourmpakis
ChemSusChem 11 (7), 1133-1133, 2018
2018
Designing Cu-Based Bimetallic Nanoparticles for CO2 Activation
J Dean, G Mpourmpakis
2017 AIChE Annual Meeting, 2017
2017
Supporting Information for: Predicting Metal-Support Interactions in Oxide-Supported Single-Atom Catalysts
K Tan, M Dixit, J Dean, G Mpourmpakis
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Artículos 1–20