Giannis Mpourmpakis

Affiliations: 
Chemical Engineering University of Pittsburgh, Pittsburgh, PA, United States 
Area:
Computational Chemistry
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"Giannis Mpourmpakis"
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Publications

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Li S, Hong S, Chen Q, et al. (2025) Vitamin B2 Operates by Dual Thermodynamic and Kinetic Mechanisms to Selectively Tailor Urate Crystallization. Journal of the American Chemical Society. 147: 4324-4337
Salem M, Mpourmpakis G. (2025) Single atom alloys aggregation in the presence of ligands. Nanoscale. 17: 2830-2840
Kwon H, Mpourmpakis G. (2023) Thermochemistry of Highly Flexible Molecules for Thermal Decomposition Analysis. Journal of Chemical Theory and Computation. 19: 3652-3663
Tang W, Yang T, Morales-Rivera CA, et al. (2023) Tautomerism unveils a self-inhibition mechanism of crystallization. Nature Communications. 14: 561
Hong S, Mallette AJ, Neeway JJ, et al. (2023) Understanding formation thermodynamics of structurally diverse zeolite oligomers with first principles calculations. Dalton Transactions (Cambridge, England : 2003)
Mallette AJ, Hong S, Freeman EE, et al. (2022) Heteroatom Manipulation of Zeolite Crystallization: Stabilizing Zn-FAU against Interzeolite Transformation. Jacs Au. 2: 2295-2306
Li S, Nagarajan AV, Du X, et al. (2022) Dissecting Critical Factors for Electrochemical CO Reduction on Atomically Precise Au Nanoclusters. Angewandte Chemie (International Ed. in English). e202211771
Salem M, Cowan MJ, Mpourmpakis G. (2022) Predicting Segregation Energy in Single Atom Alloys Using Physics and Machine Learning. Acs Omega. 7: 4471-4481
Dean J, Yang Y, Veser G, et al. (2021) CuZrO: If it exists it should be a sandwich. Physical Chemistry Chemical Physics : Pccp
Li Y, Li S, Nagarajan AV, et al. (2021) Hydrogen Evolution Electrocatalyst Design: Turning Inert Gold into Active Catalyst by Atomically Precise Nanochemistry. Journal of the American Chemical Society
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