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The study of high-order harmonic generation (HHG) in confined quantum systems is essential for developing a comprehensive physical description of harmonic generation from atoms to bulk solids. Using the time-dependent density-functional theory, we demonstrate how the symmetry of the system modulates the generation of high-order harmonic in fullerene C60 molecules along different orthogonal directions, as well as the effects of amplitude and photon energy of a linearly polarized laser on high-order harmonics generation. We found that the generation of high-order harmonics perpendicular to the laser polarization direction (LPD) is related to the symmetry of molecules along the LPD and the symmetry of molecules perpendicular to the LPD. Within a certain parameter range, the cut-off energy is linearly proportional to the laser amplitude and the laser photon energy. [ABSTRACT FROM AUTHOR]

Previous studies have found that pure even harmonics are generated from oriented CO molecules in linearly polarized laser fields. In this work, we demonstrate multi-directions pure even harmonic simultaneous generation from planar molecules in linearly polarized laser fields using the time-dependent density-functional theory. The analysis reveals that pure even harmonic generation depends on the special symmetry of the planar molecule. In the linearly polarized laser field, it is found that only when the planar molecules have reflective symmetry direction and the molecules perpendicular to the reflective symmetry direction do not have reflection symmetry can the planar molecules generate pure even harmonics along such reflective symmetry direction. When the laser polarization is perpendicular to the planar molecule, if the molecule has several these directions of such reflection symmetry, pure even harmonics will be simultaneously generated along these symmetrical directions. Moreover, when the laser polarization is along the molecular plane and perpendicular to the direction of one such reflection symmetry, even harmonic is also generated along this reflection symmetry direction, whereas odd harmonic is generated along the direction of laser polarization. The phenomenon exists in all polyatomic planar molecules with such reflection symmetry. [ABSTRACT FROM AUTHOR]

Plasmon resonances and the plasmon-induced field enhancement (FE) in sodium nanoring dimers are investigated by time-dependent density functional theory. For larger separations, the optical absorption, the induced charge response and the frequency dependent current demonstrate that there are two capacitive coupling plasmon modes. One feature of FE is that, in the surface region of the nanoring, it has a very large maximum. Another feature of FE is that, along the perpendicular bisector of the line segment joining the two nanoring center points in the middle region of the nanoring dimers, it has maxima. With the decrease of the gap distance, because of the electrons tunneling across the dimer junction and screening, collective excitation modes are changed, and the charge transfer plasmon modes emerge in the nanoring dimers. FE induced by any plasmon modes decreases in the gap region. Moreover, corresponding to different gap distances, the high-energy plasmon resonance peak almost does not shift, because this plasmon mode is mainly the collective excitation as a result of interactions among degenerate individual electronic states. [ABSTRACT FROM AUTHOR]

In sodium nanoring dimers, plasmon resonances and the plasmon-induced field enhancement are investigated by time-dependent density functional theory. The optical absorption, the induced charge response, and the frequency dependent current demonstrate that the main plasmon resonance modes are the charge transfer plasmon mode and the bonding dimer plasmon mode (BDP). Moreover, there are also two small hybridized plasmon modes. The induced field enhancement of each spatial region depends on the gap distance and the plasmon mode. For the narrow gap, the field enhancement at different positions of the straight line segments between two nanorings is almost uniformly distributed. However, for large separations, along the axial direction, the field enhancement gradually decreases in the region within the radius of the sodium atom. Then, the change of the field enhancement is nonlinear. For different plasmon modes, there is a different number of field enhancement extrema. The largest extreme value is located in the middle region. These findings are expected to play an important role in designing plasmonic nanostructures for practical applications that require coupled metallic nanoparticles with enhanced electric fields. [ABSTRACT FROM AUTHOR]

The collectivity of the electronic motion in graphene nanostructures is studied by time-dependent density functional theory (TDDFT). Compared with the plasmon in the homogeneous graphene, the plasmon in the graphene nanostructure has some different properties due to the effect of the size and the all dimensional confinement. In lower-energy resonance zone, spectral band is greatly broadening, even extending to the near-infrared spectral area, and the photoabsorption strength line splits. The absorption spectrum also depends on the edge configuration of the graphene nanostructure. The armchair-edge and the zigzag-edge play different roles in the absorption spectrum. Moreover, our results also demonstrate that most low-energy resonances are localized in the boundary region. [ABSTRACT FROM AUTHOR]

In recent years, the lead-free double perovskite Cs2AgBiBr6 has emerged as an appealing alternative to lead-based perovskites due to its nontoxicity and long-term stability. In this study, we employed methyl acetate as an antisolvent and prepared high-quality Cs2AgBiBr6 films by a facile one-step spin-coating method. The prepared films exhibited excellent crystallinity with densely packed crystal grains. The root mean square roughness and average roughness of the obtained Cs2AgBiBr6 perovskite films were 6.69 and 5.43 nm, respectively. Furthermore, the memory device based on the Cs2AgBiBr6 perovskite films exhibited uniform and repeatable bipolar resistive switching performance with an ON/OFF ratio of 15, an endurance of 80 cycles, and a retention time of 104 s. This work showcases a simple and convenient one-step spin-coating method for depositing high-quality Cs2AgBiBr6 thin films while highlighting their potential application in resistive switching memories based on lead-free double perovskites. [ABSTRACT FROM AUTHOR]