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1.
J Phys Condens Matter ; 36(32)2024 May 10.
Article in English | MEDLINE | ID: mdl-38670080

ABSTRACT

Topological phases in kagome systems have garnered considerable interest since the introduction of the colloidal kagome lattice. Our study employs first-principle calculations and symmetry analysis to predict the existence of ideal type-I, III nodal rings (NRs), type-I, III quadratic nodal points (QNPs), and Dirac valley phonons (DVPs) in a collection of two-dimensional (2D) kagome lattices M2C3(M = As, Bi, Cd, Hg, P, Sb, Zn). Specifically, the Dirac valley points (DVPs) can be observed at two inequivalent valleys with Berry phases of +πand-π, connected by edge arcs along the zigzag and armchair directions. Additionally, the QNP is pinned at the Γ point, and two edge states emerge from its projections. Notably, these kagome lattices also exhibit ideal type-I and III nodal rings protected by time inversion and spatial inversion symmetries. Our work examines the various categories of nodal points and nodal ring phonons within the 2D kagome systems and presents a selection of ideal candidates for investigating topological phonons in bosonic systems.

2.
J Phys Condens Matter ; 30(35): 355303, 2018 Sep 05.
Article in English | MEDLINE | ID: mdl-30027896

ABSTRACT

Finite-layer nanoribbon materials have long been considered as potential candidates for nanodevices with novel quantum effects. Here we constructed a series of ferromagnetic armchair silicene nanoribbons (ASiNRs) with sp 3 and sp 2-type alternating hybridizations, and found that the ASiNRs with different widths are localized in different spin-resolved electronic states. As the width parameter N is increased from 5 to 22, the ASiNR transits from indirect-gap half metallicity (HM), to indirect-gap spin semiconductor (SC), then to direct-gap SC and finally to direct-gap HM. When a temperature gradient is produced along the nanoribbons, the spin-dependent currents with the opposite flow directions are driven and a nearly perfect spin-dependent Seebeck effect (SDSE) occurs. Moreover, attributing to symmetrical spin-resolved transport channels, nearly pure thermal spin current without any accompanying charge current can be generated. In addition, for some ASiNRs with proper widths, both the thermal spin-up current and spin-down one are contributed by the electrons in energy valleys, resulting in a well-defined valley-dependent SDSE. These theoretical findings suggest that the ASiNRs with the sp 3 and sp 2-type alternating hybridizations can be outstanding candidates for future spin caloritronic devices.

3.
Phys Chem Chem Phys ; 20(29): 19424-19429, 2018 Jul 25.
Article in English | MEDLINE | ID: mdl-29992219

ABSTRACT

A hybrid structure of carbon nanotubes and graphene nanoribbons was predicted and synthesized (Y. Li et al., Nat. Nanotechnol., 2012, 7, 394-400; P. Lou, J. Phys. Chem. C, 2014, 118, 4475-4482). Herein, using the non-equilibrium Green's function (NEGF) combined with density functional theory (DFT), the thermal spin transport properties and the figure of merit (a material constant proportional to the efficiency of a thermoelectric couple made with the material) of a composite of single-walled carbon nanotubes and zigzag-edge graphene nanoribbons, labeled (6,6)SWCNT/n-ZGNR, are investigated for n = 1, 2, 3, and 8. The results manifest that spin-dependent currents with opposite flow directions were generated when a temperature gradient was applied between two electrodes, indicating the occurrence of the spin-dependent Seebeck effect (SDSE). Remarkably, when n = 3, the charge current is equal to zero, meaning that a perfect SDSE is observed. Moreover, a pure spin-dependent Seebeck diode (SDSD) effect can be observed. Finally, we notice that the device presents an n-type characteristic when n = 1, while the device has a p-type feature when n = 2. In particular, the spin-up thermopower is equal to the spin-down thermopower when n = 3; as a consequence, the charge thermopower is equal to zero, further demonstrating that a perfect SDSE is generated. These discoveries indicate that the (6,6)SWCNT/n-ZGNR is a promising candidate for spin caloritronics devices.

4.
Sci Rep ; 8(1): 927, 2018 01 17.
Article in English | MEDLINE | ID: mdl-29343845

ABSTRACT

Metal-free magnetism and spin caloritronics are at the forefront of condensed-matter physics. Here, the electronic structures and thermal spin-dependent transport properties of armchair graphene nanoribbons (N-AGNRs), where N is the ribbon width (N = 5-23), are systematically studied. The results show that the indirect band gaps exhibit not only oscillatory behavior but also periodic characteristics with E 3p > E3p+1 > E3p+2 (E 3p , E3p+1 and E3p+2 are the band gaps energy) for a certain integer p, with increasing AGNR width. The magnetic ground states are ferromagnetic (FM) with a Curie temperatures (T C ) above room temperature. Furthermore, the spin-up and spin-down currents with opposite directions, generated by a temperature gradient, are almost symmetrical, indicating the appearance of the perfect spin-dependent Seebeck effect (SDSE). Moreover, thermally driven spin currents through the nanodevices induced the spin-Seebeck diode (SSD) effect. Our calculation results indicated that AGNRs can be applied in thermal spin nanodevices.

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