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Publications by Geoffroy Hautier

The Thermodynamic Scale of Inorganic Crystalline Metastability

Science advances
Multidisciplinary
2016English

The Limited Predictive Power of the Pauling Rules

Angewandte Chemie - International Edition
CatalysisChemistry
2020English

Origins of Ultralow Thermal Conductivity in 1-2-1-4 Quaternary Selenides

Journal of Materials Chemistry A
Materials ScienceChemistrythe EnvironmentSustainabilityRenewable Energy
2019English

Effective Mass and Fermi Surface Complexity Factor From Ab Initio Band Structure Calculations

npj Computational Materials
Mechanics of MaterialsMaterials ScienceSimulationComputer Science ApplicationsModeling
2017English

YCuTe2: A Member of a New Class of Thermoelectric Materials With CuTe4-based Layered Structure

Journal of Materials Chemistry A
Materials ScienceChemistrythe EnvironmentSustainabilityRenewable Energy
2016English

Benchmarking Density Functional Perturbation Theory to Enable High-Throughput Screening of Materials for Dielectric Constant and Refractive Index

Physical Review B
OpticalElectronicCondensed Matter PhysicsMagnetic Materials
2016English

Searching for Materials With High Refractive Index and Wide Band Gap: A First-Principles High-Throughput Study

Physical Review Materials
Materials ScienceAstronomyPhysics
2019English

Synthesis and Electrochemical Properties of Monoclinic LiMnBO[sub 3] as a Li Intercalation Material

Journal of the Electrochemical Society
SurfacesCondensed Matter PhysicsOpticalElectrochemistrySustainabilityMaterials ChemistryMagnetic MaterialsRenewable EnergyFilmsCoatingsElectronicthe Environment
2011English

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