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This study demonstrates how altering the stacking sequence of boron nitride from hexagonal to rhombohedral can overcome symmetry restrictions, boosting optical emission intensity by one to two orders of magnitude while preserving magnetic properties. By using first-principles calculations, researchers predict that this structural change enables single-defect addressing at room temperature, offering a new design parameter for optimizing quantum emitters in layered materials.
Enhanced Emission from Boron-Vacancy Center in Rhombohedral Boron Nitride
arXiv:2603.21422v2 Announce Type: replace Abstract: Boron nitride is a layered crystal whose properties depend on how its atomic sheets are stacked. Its negatively charged boron vacancy is a well-established magnetic defect that can be prepared and read out optically, but in the common hexagonal form it emits very little light, because the symmetry of the surrounding lattice forbids the relevant optical transition. Here we show, using first-principles calculations, that stacking the sheets in the rhombohedral sequence instead removes this restriction and increases the emitted intensity by one to two orders of magnitude, while the magnetic properties remain comparable or improve. We predict that the resulting emission is bright enough for a single defect to be addressed at room temperature, and that a sharp emission line, absent in the hexagonal form, should appear on cooling. Stacking order therefore acts as a design parameter for tailoring the quantum properties of defects embedded in layered materials.
Abstract:Boron nitride is a layered crystal whose properties depend on how its atomic sheets are stacked. Its negatively charged boron vacancy is a well-established magnetic defect that can be prepared and read out optically, but in the common hexagonal form it emits very little light, because the symmetry of the surrounding lattice forbids the relevant optical transition. Here we show, using first-principles calculations, that stacking the sheets in the rhombohedral sequence instead removes this restriction and increases the emitted intensity by one to two orders of magnitude, while the magnetic properties remain comparable or improve. We predict that the resulting emission is bright enough for a single defect to be addressed at room temperature, and that a sharp emission line, absent in the hexagonal form, should appear on cooling. Stacking order therefore acts as a design parameter for tailoring the quantum properties of defects embedded in layered materials.
Quantum Physics (quant-ph); Materials Science (cond-mat.mtrl-sci)
arXiv:2603.21422 [quant-ph]
(or arXiv:2603.21422v2 [quant-ph] for this version)
https://doi.org/10.48550/arXiv.2603.21422 Focus to learn more arXiv-issued DOI via DataCite
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