First-principles prediction of incipient order in arbitrary high-entropy alloys: exemplified in Ti0.25CrFeNiAl
Prashant Singh, A. V. Smirnov, Aftab Alam, D. D. Johnson
Topics & Concepts
CALPHADMaterials scienceThermodynamicsDensity functional theoryHigh entropy alloysBravais latticePhase diagramShort range orderStatistical physicsStability (learning theory)Phase (matter)Condensed matter physicsMicrostructureCrystallographyCrystal structureComputational chemistryMetallurgyPhysicsComputer scienceChemistryQuantum mechanicsMachine learningHigh Entropy Alloys StudiesHigh-Temperature Coating BehaviorsChalcogenide Semiconductor Thin Films