Computational discovery of promising new n-type dopable ABX Zintl thermoelectric materials
Prashun Gorai, Alex M. Ganose, Alireza Faghaninia, Anubhav Jain, Vladan Stevanović
Abstract
We develop a chemical replacements in structure prototype (CRISP) approach for novel materials discovery with functional applications.
Topics & Concepts
Materials scienceABX testThermoelectric effectNanotechnologyPhysicsMathematicsStatisticsThermodynamicsAdvanced Thermoelectric Materials and DevicesMachine Learning in Materials ScienceThermal properties of materials