Publication details

Light emission from direct band gap germanium containing split-interstitial defects

Authors

MURPHY-ARMANDO Felipe BREHM Moritz STEINDL Petr LUSK Mark FROMHERZ T. SCHWARZ Karlheinz BLAHA Peter

Year of publication 2021
Type Article in Periodical
Magazine / Source Physical Review B
MU Faculty or unit

Faculty of Science

Citation
Web https://doi.org/10.1103/PhysRevB.103.085310
Doi http://dx.doi.org/10.1103/PhysRevB.103.085310
Keywords Spontaneous emission; k dot p method; Electronic structure; first-principles calculations; interstitials
Description The lack of useful and cost-efficient group-IV direct band gap light emitters still presents the main bottle-neck for complementary metal-oxide semiconductor-compatible short-distance data transmission, single-photon emission, and sensing based on silicon photonics. Germanium, a group-IV element like Si, is already widely used in silicon fabs. While the energy band gap of Ge is intrinsically indirect, we predict that the insertion of Ge-Ge split-[110] interstitials into crystalline Ge can open up a direct band gap transmission path. Here, we calculate from first principles the band structure and optical emission properties of Ge, Sb, and Sn split-[110] interstitials in bulk and low-dimensional Ge at different doping concentrations. Two types of electronic states provide the light-emission enhancement below the direct band gap of Ge: a hybridized L-Gamma state at the Brillouin zone center and a conduction band of Delta band character that couples to a raised valence band along the Gamma-X direction. Majority carrier introduced to the system through doping can enhance light emission by saturation of nonradiative paths. Ge-Sn split interstitials in Ge shift the top of the valence band towards the Gamma-X direction and increase the Gamma character of the L-Gamma state, which results in a shift to longer emission wavelengths. Key spectral regions for datacom and sensing applications can be covered by applying quantum confinement in defect-enhanced Ge quantum dots for an emission wavelength shift from the midinfrared to the telecom regime.

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