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Related papers: Acceptor and donor impurities in GaN nanocrystals

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Using ab initio methods based on the density functional theory, we investigate the segregation and formation energies for various dopants (Si, Be, Zn, Sn), commonly used to obtain p- or ntype conductivity in GaAs and InAs nanowires. The…

Materials Science · Physics 2015-07-02 M. Galicka , R. Buczko , P. Kacman

In this work we have employed density-functional theory with hybrid functionals to investigate the atomic and electronic structure of bare and hydrogenated Mn doped ZnO nanowires with small diameter. We determine changes in magnetic and…

Materials Science · Physics 2018-10-23 A. L. Rosa , L. L. Tacca , E. N. Lima , Th. Frauenheim

Vapor growth of semiconductors is analyzed using recently obtained dependence of the adsorption energy on the electron charge transfer between the surface adsorbed species and the bulk [Krukowski et al. J. Appl. Phys. 114 (2013) 063507,…

Materials Science · Physics 2016-11-09 Pawel Kempisty , Pawel Strak , Konrad Sakowski , Stanislaw Krukowski

Using a microscopic finite-cluster tight-binding model, we investigate the trend of the magnetic anisotropy energy as a function of the cluster size for an individual Mn impurity positioned in the vicinity of the (110) GaAs surface,We…

Materials Science · Physics 2014-10-17 M R Mahani , A Pertsova , C M Canali

The nanowire-supported quantum dot (NWQD) of GaN is an unconventional nanostructure, which is extremely promising for realization of UV photonics in general, and room-temperature single photon generation, in particular. While GaN-NWQDs have…

Applied Physics · Physics 2022-08-19 Swagata Bhunia , Ritam Sarkar , Dhiman Nag , Dipankar Jana , Suddhasatta Mahapatra , Apurba Laha

The structural and electronic properties of cubic GaN are studied within the local density approximation by the full-potential linear muffin-tin orbitals method. The Ga $3d$ electrons are treated as band states, and no shape approximation…

Condensed Matter · Physics 2009-10-22 Vincenzo Fiorentini , Michael Methfessel , Matthias Scheffler

The dependences of the maximum and the half-width of near band-edge photoluminescence of semi-insulating undoped GaAs crystals at 77K on the concentration of background acceptor impurities and the level of excitation in the range from…

Materials Science · Physics 2015-05-13 V. F. Kovalenko , S. V. Shutov , Ye. A. Baganov , M. M. Smyikalo

We investigate the properties of a single substitutional Mn impurity and its associated acceptor state on the (111) surface of Bi$_2$Se$_3$ topological insulator. Combining ab initio calculations with microscopic tight-binding modeling, we…

Materials Science · Physics 2014-12-01 M. R. Mahani , A. Pertsova , M. Fhokru Islam , C. M. Canali

In this paper, we study band-to-band and intersubband characteristics of GaN/AlN heterostructures (planar and nanowires) structurally designed to absorb in the short-wavelength infrared region, particularly at 1.55 microns. We compare the…

Materials Science · Physics 2018-12-03 A. Ajay , C. B. Lim , D. A. Browne , J. Polaczynski , E. Bellet-Amalric , J. Bleuse , M. I. den Hertog , E. Monroy

Doping problems in GaN and in AlGaN alloys are addressed on the basis of state-of-the-art first-principles calculations. For n-type doping we find that nitrogen vacancies are too high in energy to be incorporated during growth, but silicon…

Condensed Matter · Physics 2009-10-31 Chris G. van de Walle , Catherine Stampfl , Joerg Neugebauer

The donor binding energies associated with the ground state and a few excited states, are computed as a function of the dot size and the impurity position within two and three dimensional GaAs quantum dots. The calculation has been done…

Materials Science · Physics 2007-05-23 S. Baskoutas , A. F. Terzis

We investigate the electronic and magnetic properties of (Ga,Mn)N nanocrystals using the density functional theory. We study both wurtzite and zinc-blende structures doped with one or two substitutional Mn impurities. For a single Mn dopant…

Mesoscale and Nanoscale Physics · Physics 2015-03-13 C. Echeverría-Arrondo , J. Pérez-Conde , A. Ayuela

Tuning of the electronic properties of pre-synthesized colloidal semiconductor nanocrystals (NCs) by doping plays a key role in the prospect of implementing them in printed electronics devices such as transistors, and photodetectors. While…

Materials Science · Physics 2021-05-25 Yorai Amit , Yuanyuan Li , Anatoly I. Frenkel , Uri Banin

In the present theoretical work we have considered impurities, either boron or phosphorous, located at different substitutional sites in silicon quantum dots (Si-QDs) with diameters around 1.5\,nm, embedded in a SiO2 matrix. Formation…

Mesoscale and Nanoscale Physics · Physics 2015-12-02 Nuria Garcia-Castello , Sergio Illera , Joan Daniel Prades , Stefano Ossicini , Albert Cirera , Roberto Guerra

We report on the optical spectroscopy of a single InAs/GaAs quantum dot (QD) doped with a single Mn atom in a longitudinal magnetic field of a few Tesla. Our findings show that the Mn impurity is a neutral acceptor state A^0 whose effective…

Materials Science · Physics 2009-11-13 A. Kudelski , A. Lemaître , A. Miard , P. Voisin , T. C. M. Graham , R. J. Warburton , O. Krebs

The hot-wall metal-organic chemical vapor deposition (MOCVD), previously shown to enable superior III-nitride material quality and high performance devices, has been explored for Mg doping of GaN. We have investigated the Mg incorporation…

The spin orientation of a magnetic dopant in a zincblende semiconductor strongly influences the spatial structure of an acceptor state bound to the dopant. The acceptor state has a roughly oblate shape with the short axis aligned with the…

Materials Science · Physics 2007-05-23 Jian-Ming Tang , Michael E. Flatté

Dielectric constant and absorption measurements on boron doped silicon samples show that transitions between the acceptor energy levels can be induced by an applied resonant ac electric field and the Stark tuning of level spacing with an…

Quantum Physics · Physics 2015-05-20 Y. P. Song , B. Golding

Identification of complex defect has been a long-sought-after physics problem for controlling the defect population and engineering the useful properties in wide bandgap oxide semiconductors. Here we report a systematic study of (GaZn-VZn)-…

We study the nature of excitons bound to I1 basal plane stacking faults in ensembles of ultrathin GaN nanowires by continuous-wave and time-resolved photoluminescence spectroscopy. These ultrathin nanowires, obtained by the thermal…

Mesoscale and Nanoscale Physics · Physics 2016-03-16 P. Corfdir , C. Hauswald , O. Marquardt , T. Flissikowski , J. K. Zettler , S. Fernández-Garrido , L. Geelhaar , H. T. Grahn , O. Brandt