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The optical properties of GaN nanowires grown by catalyst free plasma-assisted molecular beam epitaxy on Si (111) are investigated by photoluminescence (PL) spectroscopy. The influence of the Si- and Mg-flux as well as the III-V ratio during growth on the PL properties is discussed. The Mg concentration as determined by secondary ion mass spectroscopy ranges from 5×1018 to 1×1020 cm−3. Raman scattering reveals that the nanowires are strain-free, irrespective of Si- or Mg-doping. The near band-edge emission of undoped or slightly Si-doped material is dominated by the narrow D0X recombination at 3.4715 eV with a full width at half maximum of 1.5 meV at 4 K. For high Si-fluxes, a blueshift of the D0X peak by 1 meV is found, which is attributed to band-filling effects. For moderate Mg-fluxes the acceptor-bound exciton recombination was detected at 3.4665 eV. Point defects due to the N-rich growth conditions are discussed as the origin of the emission band at 3.45 eV. Recombination at coalescence boundaries were identified as the origin of an emission band at 3.21 eV. The luminescence properties below 3.27 eV in highly Mg-doped samples are shown to be affected by the presence of cubic inclusions in the otherwise wurtzite nanowires.

Wurtzite Zn1−xMgxO thin films with Mg contents between x=0 and x=0.37 were grown on c-plane sapphire substrates by plasma assisted molecular beam epitaxy using a MgO/ZnMgO buffer layer. The a-lattice parameter is independent from the Mg concentration, whereas the c-lattice parameter decreases from 5.20 Å for x=0 to 5.17 Å for x=0.37, indicating pseudomorphic growth. The near band edge photoluminescence shows a blueshift with increasing Mg concentration to an emission energy of 4.11 eV for x=0.37. Simultaneously, the energetic position of the deep defect luminescence shows a linear shift from 2.2 to 2.8 eV. Low temperature transmission measurements reveal strong excitonic features for the investigated composition range and alloy broadening effects for higher Mg contents. The Stokes shift as well as the Urbach energy is increased to values of up to 125 and 54 meV for x=0.37, respectively, indicating exciton localization due to alloy fluctuations.

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We report on the effect of Mg doping on the properties of GaN nanowires grown by plasma assisted molecular beam epitaxy. The most significant feature is the presence of triple-twin domains, the density of which increases with increasing Mg concentration. The resulting high concentration of misplaced atoms gives rise to local changes in the crystal structure equivalent to the insertion of three non-relaxed zinc-blende (ZB) atomic cells, which result in quantum wells along the wurtzite (WZ) nanowire growth axis. High resolution electron energy loss spectra were obtained exactly on the twinned (zinc-blende) and wurtzite planes. These atomically resolved measurements, which allow us to identify modifications in the local density of states, revealed changes in the band to band electronic transition energy from 3.4 eV for wurtzite to 3.2 eV in the twinned lattice regions. These results are in good agreement with specific ab initio atomistic simulations and demonstrate that the redshift observed in previous photoluminescence analyses is directly related to the presence of these zinc-blende domains, opening up new possibilities for band-structure engineering.