38 citations · 69 across the 9 of their papers we have counts for
10 papers · 1 filter
The Precursor Genome: A Pairwise Reaction Dataset for Solid-State Synthesis
Lauren N. Walters, Matthew J. McDermott, Bernardus Rendy +3
Solid-state reactions remain the dominant route to inorganic materials, yet no large, machine-readable dataset reports their experimental protocols and outcomes with consistent pro…
Dara: Automated multiple-hypothesis phase identification and refinement from powder X-ray diffraction
Yuxing Fei, Matthew J. McDermott, Christopher L. Rom +2
Powder X-ray diffraction (XRD) is a foundational technique for characterizing crystalline materials. However, the reliable interpretation of XRD patterns, particularly in multiphas…
Data-Driven Design-Test-Make-Analyze Paradigm for Inorganic Crystals: Ultrafast Synthesis of Ternary Oxides
Haiwen Dai, Matthew J. McDermott, Andy Paul Chen +19
Data-driven methodologies hold the promise of revolutionizing inorganic materials discovery, but they often face challenges due to discrepancies between theoretical predictions and…
Synthetic accessibility and sodium ion conductivity of the NaAPO (NAP) high-temperature sodium superionic conductor framework
Lauren N. Walters, Yuxing Fei, Bernardus Rendy +13
Advancement of solid state electrolytes (SSEs) for all solid state batteries typically focuses on modification of a parent structural framework for improved conductivity, \textit{e…
ReactCA: A Cellular Automaton for Predicting Phase Evolution in Solid-State Reactions
Max C. Gallant, Matthew J. McDermott, Bryant Li +1
New computational tools for solid-state synthesis recipe design are needed in order to accelerate the experimental realization of novel functional materials proposed by high-throug…
AlabOS: A Python-based Reconfigurable Workflow Management Framework for Autonomous Laboratories
Yuxing Fei, Bernardus Rendy, Rishi Kumar +10
The recent advent of autonomous laboratories, coupled with algorithms for high-throughput screening and active learning, promises to accelerate materials discovery and innovation.…