The Materials Data Facility

Discover Data

Search Results

Neural Networks for Prediction of Electronic Excitation Dynamics

Shapera, Ethan P.; Lee, Cheng-Wei
DOI: 10.18126/y1j1-g019
Year: 2024

Combinatorial CuNiAl As-Sputtered and Annealed XRD Data

Alwen, Adie; Ziegner, Mirko; Peter, Nicolas; Schwaiger, Ruth; Hodge, Andrea
DOI: 10.18126/32wy-3a03
Year: 2024

D3TaLES: DFT Computations for Redox-Active Small Organic Molecule

Duke-Crockett, Rebekah; Bhat, Vinayak; Sornberger, Parker; Odom, Susan A.; Risko, Chad
DOI: 10.18126/v5sj-6q93
Year: 2024

High-Throughput DFT data for screening of halide perovskite photocatalysts

Maitreyo Biswas, Arun Mannodi-Kanakkithodi
DOI: 10.18126/s5j2-a428
Year: 2024

Grain structure evolution during heat treatment of a Al-5wt%Cu alloy studied with lab-based diffraction contrast tomography

Sun, Jun; Oddershede, Jette; Dake, Jules
Organizations: MDF Open
DOI: 10.18126/5q8s-3ef9
Year: 2023

Labeled Dataset of Hydrogen and Oxygen Bubbles Evolving on Electrodes

Lake, Jack; Rufer, Simon; James, Jim; Pruyne, Nathan; Scourtas, Aristana; Schwarting, Marcus; Ambadkar, Aadit; Foster, Ian; Blaiszik, Ben; Varanasi, Kripa K.
Organizations: MDF Open
DOI: 10.18126/9pj2-hpef
Year: 2023

Cold spray dataset through molecular dynamics simulations

Nikravesh, Yousef; Muralidharan, Krishna; Frantziskonis, George; Latypov, Marat
Organizations: MDF Open
DOI: 10.18126/7k43-j8b4
Year: 2023

High Throughput EBSD Characterization of Additive Kovar

Fowler, J. Elliott; Ruggles, Tim J.; Cillessen, Dale E.; Johnson, Kyle L.; Jauregui, Luis J.; Henriksen, Amelia A.; Bianco, Nathan R.; Boyce, Brad L.
Organizations: MDF Open
DOI: 10.18126/7d9u-edev
Year: 2023

Dataset for Cloud Services Enable Efficient AI-Guided Simulation Workflows across Heterogeneous Resources

Ward, Logan; Pauloski, J. Gregory; Hayot-Sasson, Valerie; Chard, Ryan; Babuji, Yadu; Sivaraman, Ganesh; Choudhury, Sutanay; Chard, Kyle; Thakur, Rajeev; Foster, Ian
Organizations: MDF Open
DOI: 10.18126/ld7m-5bb5
Year: 2023

Accelerating Crystal Structure Prediction of Organic Salts via Machine Learning

Shapera, Ethan P.; Bucar, Dejan-Kresimir; Prasankumar, Rohit P.; Heil, Christoph
Organizations: MDF Open
DOI: 10.18126/ac06-tft6
Year: 2023