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Wyświetlanie 1-15 z 68
Tytuł:
A Model of Radiative Recombination in (In,Al,Ga)N/GaN Structures with Significant Potential Fluctuations
Autorzy:
Dróżdż, P.
Korona, K.
Sarzyński, M.
Czernecki, R.
Skierbiszewski, C.
Muzioł, G.
Suski, T.
Powiązania:
https://bibliotekanauki.pl/articles/1185815.pdf
Data publikacji:
2016-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
78.55.Cr
73.22.-f
78.47.jd
Opis:
The potential fluctuations in III-nitride quantum wells lead to many effects like emission broadening and S-shape energy vs. temperature dependence. The best description of the energy dependence comes from calculations based on Gaussian density of states. However, in most of the published reports, changes of carrier lifetime with energy and temperature are not taken into account. Since experimental evidence shows that lifetime significantly depends on energy and temperature, here we propose a model that describes two basic parameters of luminescence: lifetime of carries and emission energy as a function of temperature in the case of quantum wells and layers that are characterized by potential fluctuations. Comparison of the measured energy and lifetime dependences on temperature in specially grown InGaN/GaN quantum wells and InAlGaN layer shows very good agreement with the proposed theoretical approach.
Źródło:
Acta Physica Polonica A; 2016, 130, 5; 1209-1212
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Ab Initio Analysis of a Quantum Dot Induced by a Local External Potential in a Semiconducting Carbon Nanotube
Autorzy:
Kostyrko, T.
Krompiewski, S.
Powiązania:
https://bibliotekanauki.pl/articles/1810605.pdf
Data publikacji:
2009-01
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
61.48.De
85.35.Kt
73.21.La
73.22.-f
Opis:
Using the density functional theory we study the influence of external charge probes on the electronic structure of semiconducting carbon nanotubes in the vicinity of the Fermi level. We show that the spatially limited potential due to the probe can create localized electronic states in the energy gap and at the edges of the conductance band. By filling these localized states with additional electrons one obtains a quantum dot, which can be tuned by modifying the properties of the external charge probe. We analyze dependence of the electronic structure of the dot on the spatial extension of the potential as well as on the nanotube radius.
Źródło:
Acta Physica Polonica A; 2009, 115, 1; 387-389
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Ab Initio Study of Functionalized Carbon Nanotubes
Autorzy:
Milowska, K.
Birowska, M.
Majewski, J.
Powiązania:
https://bibliotekanauki.pl/articles/1791295.pdf
Data publikacji:
2009-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
31.15.ae
31.15.E-
61.46.Fg
61.48.De
73.22.-f
81.07.De
Opis:
In the present paper, we study the stability of (9, 0), (10, 0), (11, 0) carbon nanotubes functionalized with simple organic molecules $-CH_{n}$ (for n = 2, 3, 4). Our studies are based on ab initio calculations within the framework of the density functional theory. We determine binding energies of the functionalized carbon nanotubes and the changes in the geometry and electronic structure caused by the functionalization. We observe the characteristic effects such as rehybridization of the bonds induced by fragments attached to carbon nanotubes and pentagon/heptagon (5/7) defects in $-CH_{2}$ functionalized carbon nanotubes. We study also dependence of the binding energies of the functionalized carbon nanotubes on the density of the adsorbed molecules and diameter of the single-wall carbon nanotubes. Our calculations reveal that the $-CH_{2}$ fragments exhibit the strongest cohesion and we determine the critical density of the $-CH_{2}$ fragments which could be adsorbed.
Źródło:
Acta Physica Polonica A; 2009, 116, 5; 841-843
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Advantages of the DFT Augmented Symmetry Approach to Simulations of the Chromium-Based Ring Cr₈ within B3LYP Functional
Autorzy:
Brzostowski, B.
Wojciechowski, M.
Kamieniarz, G.
Powiązania:
https://bibliotekanauki.pl/articles/1030669.pdf
Data publikacji:
2018-03
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
75.50.Xx
71.15.Mb
73.22.-f
75.30.Et
31.15.E
Opis:
The DFT estimates of magnetic couplings in molecular nanomagnets are computationally demanding and their values have not achieved the satisfactory accuracy in spite of a lot of effort. We concentrate here on comprehensive tests for predictions of the recently proposed augmented symmetry approach aiming at reducing the computational complexity of the DFT calculations which is particularly important for the Wien2k code. Using the B3LYP functional, we demonstrate the numerical stability of magnetic couplings, magnetic moments and the HOMO-LUMO gaps, changing the fraction of exact exchange α. We reach the significant gain in the computing time without a loss in the accuracy of the final results with respect to those obtained by the standard PBE approach. We conclude that the value α=0.25 leads to best estimation of magnetic couplings for hybrid functionals within Wien2k.
Źródło:
Acta Physica Polonica A; 2018, 133, 3; 591-593
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Application of the Dot-Ring Nanostructure to Control Electrical Transport in the Coulomb Blockade Regime
Autorzy:
Janus-Zygmunt, I.
Kędzierska, B.
Gorczyca-Goraj, A.
Kurpas, M.
Maśka, M.
Zipper, E.
Powiązania:
https://bibliotekanauki.pl/articles/1376091.pdf
Data publikacji:
2014-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.23.Hk
73.21.La
73.22.-f
Opis:
Transport properties of a two-dimensional nanostructure composed of a quantum dot surrounded by a quantum ring (dot-ring nanostructure), are discussed. This complex system is a highly controllable object. Conduction through dot-ring nanostructure depends crucially on the coupling strength of its states to the electrodes, which is related to the spatial distribution of the electron's wave functions in dot-ring nanostructure. This distribution can be strongly modified, e.g., by the electrical gating so that the ground and excited states move between the inner dot and the outer ring. In this paper we show that this property can be used to control single-electron DC current through dot-ring nanostructure in the Coulomb blockade regime so that it can be used as a single electron transistor.
Źródło:
Acta Physica Polonica A; 2014, 126, 5; 1171-1173
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Application of the Package SIESTA to Linear Models of a Molecular Chromium-Based Ring
Autorzy:
Ślusarski, T.
Brzostowski, B.
Tomecka, D.
Kamieniarz, G.
Powiązania:
https://bibliotekanauki.pl/articles/1534920.pdf
Data publikacji:
2010-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
75.50.Xx
71.15.Mb
73.22.-f
75.30.Et
Opis:
We investigate for the first time the electronic and magnetic properties of the linear models of $Cr_8F_8(Piv)_{16}$ molecular ring using the SIESTA package. In the first step the proper values of the SIESTA parameters and the optimal basis set needed for the convergence of the total energy are established. Next the estimates of the magnetic coupling J confirming the previous density functional theory calculations are presented.
Źródło:
Acta Physica Polonica A; 2010, 118, 5; 967-968
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Band Structure and Quantum Conductance of Metallic Carbon Nanotube Superlattices
Autorzy:
Jaskólski, W.
Stachów, A.
Chico, L.
Powiązania:
https://bibliotekanauki.pl/articles/2043721.pdf
Data publikacji:
2005-10
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.22.-f
73.63.-b
Opis:
The electronic structure and quantum conductance of rotationally invariant (6,6)/(12,0) and rotationally non-invariant (5,5)/(8,2) superlattices made of metallic carbon nanotubes are investigated. It is shown that, except in the limit of very large periods, the quantum conductance of such superlattices does not critically depend on their rotational invariance, although it does in case of quantum dots and single junctions made of these nanotubes.
Źródło:
Acta Physica Polonica A; 2005, 108, 4; 697-704
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Collective Phenomena in Multiwall Carbon Nanotubes
Autorzy:
Margańska, M.
Szopa, M.
Zipper, E.
Powiązania:
https://bibliotekanauki.pl/articles/2038389.pdf
Data publikacji:
2004-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.22.-f
73.23.Ra
Opis:
Collective phenomena due to persistent currents in carbon multiwall nanotubes are studied. The formula for persistent currents minimising free energy and conditions for the stability of persistent currents in multiwall nanotubes in magnetic field are derived. Numerical calculations performed show the possibility of obtaining spontaneous currents in two optimal configurations: undoped armchair-only multiwall nanotubes up to 0.01 K, and zig-zag-chiral-chiral-zig-zag multiwall nanotubes doped to -3.033 eV up to about 1 K. The latter configuration may exhibit also the diamagnetic expulsion of magnetic field, which according to our calculations can reach 20% of the external flux.
Źródło:
Acta Physica Polonica A; 2004, 106, 5; 609-616
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Correlations in Hexagonal Lattice Systems - Application to Carbon Nanotubes
Autorzy:
Czajka, K.
Maśka, M. M.
Powiązania:
https://bibliotekanauki.pl/articles/2041458.pdf
Data publikacji:
2004-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.22.-f
71.15.Dx
Opis:
We present exact diagonalization studies of two-dimensional electron gas on hexagonal lattice. Using Lanczös method we analyze the influence of the Coulomb correlations on the density of states and spectral functions. Choosing appropriate boundary conditions we simulate the geometry of a single wall carbon nanotube. In particular, integration over the boundary condition in one direction and summation in the other one allows us to perform cluster calculations for a tube-like system with a finite diameter and infinite length.
Źródło:
Acta Physica Polonica A; 2004, 106, 5; 703-707
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Cotunneling Transport at Singlet-Triplet Transition in Carbon Nanotube Quantum Dots
Autorzy:
Ilnicki, G.
Moriyama, S.
Martinek, J.
Fuse, T.
Ishibashi, K.
Powiązania:
https://bibliotekanauki.pl/articles/1810544.pdf
Data publikacji:
2009-01
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.22.-f
73.23.Hk
73.63.Fg
Opis:
Electronic transport through a quantum dot in the Coulomb-blockade cotunelling regime is investigated both experimentally and theoretically, where a single-wall carbon-nanotube weakly coupled to metallic leads plays a role of the dot. We observe a pronounced current peak for the singlet-triplet transition in a half-shell filling regime due to inelastic cotunneling processes. Using the second order perturbation theory we explain physical mechanisms determining the details of signal.
Źródło:
Acta Physica Polonica A; 2009, 115, 1; 299-302
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
DFT and Falicov-Kimball Model Approach to $Cr_{9}$ Molecular Ring
Autorzy:
Brzostowski, B.
Wojciechowski, M.
Lemański, R.
Kamieniarz, G.
Timco, G.
Tuna, F.
Winpenny, R.
Powiązania:
https://bibliotekanauki.pl/articles/1368686.pdf
Data publikacji:
2014-07
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
75.50.Xx
71.15.Mb
73.22.-f
75.30.Et
Opis:
Based on density functional theory (DFT) calculations, we present electronic and magnetic properties of nanometallic homo-nuclear chromium-based molecular rings $Cr_{9}F_{9}Cl_{2}(O_{2}C-C(CH_{3})_{3})_{17}$ recently synthesized. The magnetic moments are calculated, the spin density maps are discussed and the exchange interaction parameter is extracted. The complementary studies are carried out using the Falicov-Kimball model which reproduces very well the energy levels determined by different magnetic broken symmetry configurations obtained by DFT.
Źródło:
Acta Physica Polonica A; 2014, 126, 1; 270-271
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
DFT Estimation of Exchange Coupling Constant of Cr₈ Molecular Ring using the Hybrid Functional B3LYP
Autorzy:
Wojciechowski, M.
Brzostowski, B.
Kamieniarz, G.
Powiązania:
https://bibliotekanauki.pl/articles/1386209.pdf
Data publikacji:
2015-02
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
75.50.Xx
71.15.Mb
73.22.-f
75.30.Et
31.15.E-
71.10.-w
Opis:
A study of electronic and magnetic properties of an octametallic chromium-based homonuclear molecule Cr₈F₈(CO₂-C(CH₃)₃)₁₆ is presented, using density functional theory (DFT) approach and linearized augmented plane wave (LAPW) method with Perdew, Burke and Ernzerhof (PBE) and Becke 3-term correlation (B3LYP) functionals. The exchange coupling parameters between transition metals ions are extracted, taking into account two different (ferro- and antiferromagnetic) spin configurations. The value J=3.1 meV found for the hybrid B3LYP functional improves significantly the one obtained for the PBE functional and gives an evidence for the superiority of the former in simulation of molecular nanomgnets. Moreover, the hybrid functional yields excellent spin density localisation, an enhancement of the HOMO-LUMO gaps and the value 2.81 $μ_B$ of magnetic moment at the chromium centre in good agreement with experiment.
Źródło:
Acta Physica Polonica A; 2015, 127, 2; 407-409
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
DFT Study of Octanuclear Molecular Chromium-Based Ring Using New Pseudopotential Parameters
Autorzy:
Brzostowski, B.
Ślusarski, T.
Kamieniarz, G.
Powiązania:
https://bibliotekanauki.pl/articles/1427181.pdf
Data publikacji:
2012-05
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
75.50.Xx
71.15.Mb
73.22.-f
75.30.Et
Opis:
We present a comprehensive study of magnetic properties of $Cr_8F_8(Piv)_{16}$ molecular ring (in short Cr8) using the package SIESTA with several choices of chromium pseudopotential parameters. We use generalized gradient approximation to investigate properties of Cr8 ring approximated by replacing the pivallic group by H atoms (hydrogen saturation). For different choice of chromium pseudopotential we examine the electronic and magnetic properties of Cr8 molecule. We compare highest occupied molecular orbital and the lowest unoccupied molecular orbital gaps for both spin channels, magnetic moments, and exchange interaction parameter J. The influence of pseudopotential parameters on obtained results is discussed. Finally our results are compared with other theoretical approaches and experimental data.
Źródło:
Acta Physica Polonica A; 2012, 121, 5-6; 1115-1117
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Efficient Emission from InAlGaAs Single Quantum Dots with Low Lattice Misfit and AlGaAs Indirect Bandgap Barrier
Autorzy:
Słupiński, T.
Korona, K.
Papierska, J.
Borysiuk, J.
Powiązania:
https://bibliotekanauki.pl/articles/1398581.pdf
Data publikacji:
2016-11
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
78.55.Cr
73.22.-f
78.47.jd
Opis:
We report on molecular beam epitaxy growth and properties of rarely studied quaternary In_{0.4}(Al_{0.75}Ga_{0.25})_{0.6}As self-assembled quantum dots, which show strong and efficient emission of red light from single quantum dots. The increased yield is, among others, due to efficient energy transfer from indirect band-gap Al_{0.75}Ga_{0.25}As barriers. To maximize photon energy emitted from quantum dots, low In composition, x_{In} = 0.4 was applied, which also lowered the lattice misfit close to the limit of 2D/3D transition in the Stranski-Krastanov growth mode. Time-resolved micro-photoluminescence shows emission at 650-750 nm. Well-resolved single quantum dot photoluminescence lines (decay time of ≈ 1-2 ns) are observed despite a high concentration ≈ 3×10¹¹ cm¯² of quantum dots. We discuss this observation assuming newly a role of carriers or excitons diffusion/tunneling between quantum dots at high surface concentration of dots and a possible role of lattice disorder inside the dot on the exciton lifetime.
Źródło:
Acta Physica Polonica A; 2016, 130, 5; 1229-1232
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Tytuł:
Electrical Characterizations of Schottky Diodes οn ITO Modified by Aromatic SAMs
Autorzy:
Havare, A.
Okur, S.
Yagmurcukardes, N.
Can, M.
Aydin, H.
Seker, M.
Demic, S.
Powiązania:
https://bibliotekanauki.pl/articles/1400033.pdf
Data publikacji:
2013-02
Wydawca:
Polska Akademia Nauk. Instytut Fizyki PAN
Tematy:
73.20.Hb
73.20.Mf
73.21.-b
73.22.-f
73.25.+i
73.40.Ei
73.40.Jn
73.40.Ns
Opis:
In order to understand the electronic properties of the organic Schottky diode, ITO/TPD/Al and ITO/SAM/TPD/Al organic Schottky devices were fabricated to obtain current-voltage characteristics. From the slopes and y-axis intercepts of the plots, the values of the ideality factor, barrier heights of the ITO/SAM/TPD/Al diode were determined as 2.03 and 0.56 eV, respectively. The surface characterizations of modified and unmodified ITO were performed via atomic force microscopy.
Źródło:
Acta Physica Polonica A; 2013, 123, 2; 456-458
0587-4246
1898-794X
Pojawia się w:
Acta Physica Polonica A
Dostawca treści:
Biblioteka Nauki
Artykuł
Wyświetlanie 1-15 z 68

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