Multiscale Modeling & Materials by Desig

Gerry Knapp
- Multiscale Modeling & Materials by Desig - Process Modeling for Advanced Manufactur
Person
20132025
Sunyong Kwon
- Multiscale Modeling & Materials by Desig - Computational Thermodynamics- R&D Associ
Person
20152026
Yuri Osetskiy
- Multiscale Modeling & Materials by Desig - GrpMbr, Microstructure Evolution Modelin
Person
19882025

Accelerated discovery of OER catalysts in Pnma perovskites via machine learning with minimal DFT structure relaxation
Kim, C., Yoon, M. & Lee, J. H., Jan 2026, In: Computational Materials Science. 261, 114320.
Research output: Contribution to journal › Article › peer-review
2 Scopus citations
A first principles approach for determining solute effect on electrical resistivity of Aluminum solid solution
Samolyuk, G., Shyam, A. & Yoon, M., Mar 15 2026, In: Scripta Materialia. 274, 117138.
Research output: Contribution to journal › Article › peer-review
Correction to “Water-Assisted Concerted Layer Growth of T_d-Phase WTe₂for Nonlinear Hall Effect and Microwave Rectification”
Wu, S., Liu, Y. F., Kwon, S. Y., Lim, T. Y., Yeom, S., Gao, A., Li, H., Unocic, R. R., Varghese, A. M., Lopez-Torres, E., Xiao, K., Chang, T. R., Yoon, M., Xu, S. Y. & Li, X., Jan 21 2026, In: Nano Letters. 26, 2, p. 932 1 p.
Research output: Contribution to journal › Comment/debate

2021 R&D 100 Award for UCC: Ultraconductive Copper-Carbon Nanotube Composite
Aytug, T. (Recipient), Li, K. (Recipient), Ozpineci, B. (Recipient), McGuire, M. (Recipient), List III, F. (Recipient), Ozcan, S. (Recipient), Skolrood, L. (Recipient), Ivanov, I. (Recipient), Yoon, M. (Recipient) & Lupini, A. (Recipient), 2021
Prize: Honorary award
2022 R&D 100 Award for DuAlumin-3D: An Additively Manufactured Dual-Strengthened Aluminum Alloy Designed for Extreme Creep and Fatigue Resistance
Plotkowski, A. (Recipient), Wang, Q. (Recipient), Jones, J. (Recipient), Wang, A. (Recipient), Hess, D. (Recipient), Wilson, D. (Recipient), Gerard, D. (Recipient), Burkle, D. (Recipient), Jones, R. (Recipient), Stansberry, C. (Recipient), Shyam, A. (Recipient), Dehoff, R. (Recipient), Haynes, J. A. (Recipient), Michi, R. A. (Recipient), Bahl, S. (Recipient), Yang, Y. (Recipient), Allard Jr, L. (Recipient), Poplawsky, J. (Recipient), Peter, B. (Recipient), Splitter, D. (Recipient), Jun, J. (Recipient) & Sisco, K. (Recipient), 2022
Prize: Honorary award

NbZr_BCC_SolidSolution_128atoms_VASP6
Samolyuk, G. (Creator), Eisenbach, M. (Creator), Lupo Pasini, M. (Creator), Choi, J. Y. (Creator), Rogers, D. (Creator) & Yang, Y. (Creator), Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Oak Ridge Leadership Computing Facility (OLCF); Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States), 2024
DOI: 10.13139/olcf/2466323
Dataset
A Co-Registered In-Situ and Ex-Situ Dataset from a Laser Powder Bed Fusion Additive Manufacturing Process (Peregrine v2023-10)
Scime, L. (Creator), Snow, Z. (Creator), Ziabari, A. (Creator), Halsey, W. (Creator), Joslin, C. (Creator), Knapp, G. (Creator), Coleman, J. (Creator), Peles, A. (Creator), Graham, S. (Creator), Marquez Rossy, A. (Creator), Duncan, R. (Creator) & Paquit, V. (Creator), Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Oak Ridge Leadership Computing Facility (OLCF); Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States), Oct 18 2023
DOI: 10.13139/ORNLNCCS/2008021
Dataset
NbV_BCC_SolidSolution_128atoms_VASP6
Lupo Pasini, M. (Creator), Samolyuk, G. (Creator), Eisenbach, M. (Creator), Choi, J. Y. (Creator), Yin, J. (Creator) & Yang, Y. (Creator), Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States). Oak Ridge Leadership Computing Facility (OLCF); Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States), Dec 13 2023
DOI: 10.13139/OLCF/2228839
Dataset

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