First-principles calculations to investigate Zr substitution enhanced thermoelectric performance of p-type ZrxHf1−xCoBi (x = 0,0.25,0.5,0.75,1) compounds

Quanwei Jiang, Rundong Wan, Zhengfu Zhang, Ying Lei, Guocai Tian

2021Physics Letters A16 citationsDOI

Topics & Concepts

PhysicsSubstitution (logic)Type (biology)Thermoelectric effectZirconiumAtomic physicsCrystallographyQuantum mechanicsInorganic chemistryChemistryComputer scienceEcologyProgramming languageBiologyAdvanced Thermoelectric Materials and DevicesThermal properties of materialsThermal Expansion and Ionic Conductivity

First-principles calculations to investigate Zr substitution enhanced thermoelectric performance of p-type ZrxHf1−xCoBi (x = 0,0.25,0.5,0.75,1) compounds

Topics & Concepts

First-principles calculations to investigate Zr substitution enhanced thermoelectric performance of p-type ZrxHf1−xCoBi (x = 0,0.25,0.5,0.75,1) compounds