38 citations · 38 across the 1 of their papers we have counts for
3 papers · 1 filter
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…
The ab initio amorphous materials database: Empowering machine learning to decode diffusivity
Hui Zheng, Eric Sivonxay, Max Gallant +4
Amorphous materials exhibit unique properties that make them suitable for various applications in science and technology, ranging from optical and electronic devices and solid-stat…
Assessing Thermodynamic Selectivity of Solid-State Reactions for the Predictive Synthesis of Inorganic Materials
Matthew J. McDermott, Brennan C. McBride, Corlyn Regier +11
Synthesis is a major challenge in the discovery of new inorganic materials. Currently, there is limited theoretical guidance for identifying optimal solid-state synthesis procedure…