Accurate Prediction of Defect Properties in Density Functional Supercell Calculations

Alex Zunger

doi:10.1088/0965-0393/17/8/084002

Accurate Prediction of Defect Properties in Density Functional Supercell Calculations

Alex Zunger

Chemistry and Nanoscience

National Renewable Energy Laboratory

Research output: Contribution to journal › Article › peer-review

Original language	American English
Number of pages	14
Journal	Modelling and Simulation in Materials Science and Engineering
Volume	17
Issue number	8
DOIs	https://doi.org/10.1088/0965-0393/17/8/084002
State	Published - 2009

NREL Publication Number

NREL/JA-590-46943

Keywords

basic sciences
materials science

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10.1088/0965-0393/17/8/084002

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author = "Alex Zunger",

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Accurate Prediction of Defect Properties in Density Functional Supercell Calculations

NREL Publication Number

Keywords

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