108 citations · 236 across the 8 of their papers we have counts for
8 papers
Micro-environment of the Eu interstitial in -SiAlON:Eu green phosphor
Julien Bouquiaux, Samuel Poncé, Yongchao Jia +2
The precise atomic-scale structure around Eu activators in the -SiAlON:Eu commercial green phosphor remains elusive. We use the first-princ…
Abinit 2025: New Capabilities for the Predictive Modeling of Solids and Nanomaterials
Matthieu J. Verstraete, Joao Abreu, Guillaume E. Allemand +71
Abinit is a widely used scientific software package implementing density functional theory and many related functionalities for excited states and response properties. This paper p…
A First-Principles Explanation of the Luminescent Line Shape of SrLiAlN:Eu Phosphor for Light-Emitting Diode Applications
Julien Bouquiaux, Samuel Poncé, Yongchao Jia +3
White light-emitting diodes are gaining popularity and are set to become the most common light source in the U.S. by 2025. However, their performance is still limited by the lack o…
Design rule for the emission linewidth of Eu-activated phosphors
Yongchao Jia, Samuel Poncé, Anna Miglio +2
We study from first principles the emission linewidth of Eu-doped LED phosphors. Based on the one-dimensional configuration coordinate model, an analysis of first principles…
Importance of long-range channel Sr displacements for the narrow emission in Sr[LiAlON]:Eu phosphor
Julien Bouquiaux, Samuel Poncé, Yongchao Jia +3
The recently discovered Sr[LiAlON]:Eu red phosphor, candidate for the next generation of eco-efficient white light-emitting diodes, exhibits excellent emissi…
Assessment of First-Principles and Semiempirical Methodologies for Absorption and Emission Energies of Ce-Doped Luminescent Materials
Yongchao Jia, Samuel Poncé, Anna Miglio +2
In search of a reliable methodology for the prediction of light absorption and emission of Ce-doped luminescent materials, 13 representative materials are studied with first…