Journal of Materials Chemistry C · 2017 · 32 citations · 53 references
EngineeringNon-oxide MaterialsSemiconductorsNanoelectronicsRational DesignQuantum MaterialsHigh-throughput CalculationsCharge Carrier TransportP-type TransparentCompound SemiconductorMaterials ScienceMaterials EngineeringElectrical EngineeringOxide ElectronicsGallium OxideSemiconductor MaterialPromising Chalcogenide-based SemiconductorsElectrical PropertyTransition Metal ChalcogenidesElectronic MaterialsApplied PhysicsFunctional MaterialsSolar Cell Materials
In this work, high-throughput <italic>ab initio</italic> calculations are employed to identify the most promising chalcogenide-based semiconductors for p-type transparent conducting materials (TCMs).
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Generalized Gradient Approximation Made Simple
John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 203.9K citations · Full text
Projector augmented-wave method
Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 87.4K citations