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1
Published in 2021 at "ACS Omega"
DOI: 10.1021/acsomega.1c04806
Abstract: Inorganic metal-halide perovskites hold a lot of promise for solar cells, light-emitting diodes, and lasers. A thorough investigation of their optoelectronic properties is ongoing. In this study, the accurate modified Becke Johnson generalized gradient approximation…
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Keywords:
theory analysis;
gga method;
density functional;
optical properties ... See more keywords
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2
Published in 2023 at "Crystals"
DOI: 10.3390/cryst13050754
Abstract: Based on the density functional theory, the effect of rare-earth La doping at different concentrations on the electronic structure, optical properties, and magnetic properties of ZnO was calculated by using the GGA+U method under the…
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Keywords:
electronic structure;
zno system;
gga method;
doped zno ... See more keywords