National Institute Of Materials Physics - Romania

We study the validity of Hund's first rule for the spin multiplicity in circular molecules-made of real or artificial atoms such as quantum dots-by considering a perturbative approach in the Coulomb interaction in the extended Hubbard model with both on-site and long-range interactions. In this approximation, we show that an anti-Hund rule always defines the ground state in a molecule with 4N atoms at half-filling. In all other cases (i.e., number of atoms not a multiple of four, or a 4N molecule away from half-filling) both the singlet and the triplet outcomes are possible, as determined primarily by the total number of electrons in the system. In some instances, the Hund rule is always obeyed and the triplet ground state is realized mathematically for any values of the on-site and long-range interactions, while for other filling situations the singlet is also possible but only if the long-range interactions exceed a certain threshold, relatively to the on-site interaction.

This paper reports on the aging of carbon nanowalls (CNW) and modification of their wettability by the storage time, growth conditions, and post-fabrication plasma treatments. The as-deposited CNW initially exhibit marked hydrophilic behavior (fresh CNW), but within a few days they become highly hydrophobic (aged CNW). Their final hydrophobicity is closely related to their topography which is controlled by the deposition parameters. In addition, subsequent fluorinated plasma treatments result in super-hydrophobic CNW layers, irrespective of the hydrophilic or hydrophobic character of the pre-treated samples. To explain this, we show that the CNW edges contain many defects initially, but such defects become passivated in time. As a result, the surfaces become highly hydrophobic after aging or fluorination, having inert stable terminations.

Using the kp theory and configuration interaction method, we analyze the effect of heavy hole-light hole (HH-LH) mixing in CdTe quantum dots (QDs) with a single manganese (Mn) ion. We find that the hole-Mn exchange switches the coupling between two excitons whose Luttinger spinors have both HH and LH components. If the magnetic dopant is off-centered and the QD is subjected to a single pulse the system periodically bounces between bright and dark mostly HH excitons with opposite HH spins. A pump-and-probe setup allows to estimate the efficiency of this HH spin unpinning from the biexciton response. The biexciton absorption spectrum is also discussed.

Shape memory alloys are known to memorise one -or several-temperatures at which the martensite-austenite transformation was stopped before completion in the past, the memory manifesting as specific dips in subsequent calorimetric scans. Previous studies have shown that this memory can be erased by heating to higher temperatures than the ones previously recorded. In this paper, we study a distinct memory fading effect which takes place by heating to a lower temperature. This effect is reported in NiFeGa as polycrystalline ribbons, the alloy being initially studied as bulk for which the thermal memory effect was not found. If, after an initial incomplete heating up to T-1 one performs a second incomplete heating up to T-2 < T-1, a new calorimetric dip appears at T-2, as expected, while less expected was that the dip corresponding to T-1 reduces in amplitude or even vanishes ( if the arrest at T-2 is repeated). The memory fading effect is more clear for small differences T-1-T-2 and less obvious or absent for large ones. The second part of the paper employs a statistical 2D model, which associates the memorized temperatures with a depletion of certain martensite plates sizes, and also supports the memory fading effect.

In this paper, we investigate the influence of Cu, Co, and Al substitutions on the transport properties, and in particular, the magnetoresistive effect in Ni-Fe-Ga ferromagnetic shape memory alloys (FSMAs) prepared as ribbons by melt spinning method and subjected to different thermal treatments. X-ray diffraction, differential scanning calorimetry, magnetometry, and magnetoresistive characterizations were performed. In the range of the martensitic transformation (MT), different FSMA compositions show a rich spectrum of different behaviors. For one of the compositions (Ni52Fe20Co2Ga23Al3), the magnetoresistance (MR) showed a local minimum or, on the contrary, a local maxima of reduced amplitude on cooling, in the range of the MT, depending on the performed thermal treatments. In the same composition, by replacing one Al atom with a Co one, no local extremes are seen, the alloy having a concomitant magneto-structural transition. When the magnetic field was varied, the MR showed a nonmonotonic variation in the martensite phase for some compounds, possibly due to the dynamics of the martensite variants realignment. From the studied compositions, the highest MR found on the MT of -9% for 5 T is for Ni50Fe20Ga27Cu3.

We study Coulomb interacting electrons confined in polygonal quantum rings. We focus on the interplay of localization at the polygon corners and Coulomb repulsion. Remarkably, the Coulomb repulsion allows the formation of in-gap states, i.e., corner-localized states of electron pairs or clusters shifted to energies that were forbidden for non-interacting electrons, but below the energies of corner-side-localized states. We specify conditions allowing optical excitation to those states.

The phase shift of the electron's wave function after a tunneling event (i.e. the transmission phase) was at first measured for its fundamental or applicative relevance for quantum circuitry, but later the phase study self-motivated due to a number of unexpected results. One such result was the reduced increment of the phase on some resonances - with only fractions of pi - in the few-electrons "mesoscopic" regime. In this paper we address such a regime for a rectangular quantum dot and compute the total phase increase on the first four resonances by means of accurate configuration-interaction method and a generalized Friedel sum rule as proposed by Rontani (2006) [17]. Our findings confirm that the electronic correlations reduce the on-resonance phase growth which is also found to decrease quasi-linearly with the dot size, the decrease being more pronounced as the number of electrons on the dot is raised. Sudden jumps (of small amplitude) of the phase are found to accompany ground states spin transitions. (C) 2016 Elsevier B.V. All rights reserved.

When a quantum dot is embedded into a superconducting environment, it leads to the formations of localized Shiba states inside the gap. If the Coulomb interaction is sufficiently small, the Shiba states consist of a pair of singlet states and a doublet, that compete for the ground state and induce a quantum phase transition. In the presence of an external microwave field, the Shiba energy spectrum is significantly modified. Moreover, the transmission of the cavity inherits features that can pinpoint the exact location of the quantum critical point. In terms of methods used, our analytical calculations are supplemented by state of the art numerical renormalization group calculations.

We develop a manifest non-Hermitian approach of spectral and transport properties of two-dimensional mesoscopic systems in a strong magnetic field. The finite system to which several terminals are attached constitutes an open system that can be described by an effective Hamiltonian. The lifetime of the quantum states expressed by the energy imaginary part depends specifically on the lead-system coupling and makes the difference among three regimes: resonant, integer quantum Hall effect, and superradiant. The discussion is carried on in terms of edge state lifetime in different gaps, channel formation, role of hybridization, and transmission coefficients quantization. A toy model helps in understanding non-Hermitian aspects in open systems.

We present detailed spectral calculations for small Lieb lattices having up to N = 4 number of cells, in the regime of half-filling, an instance of particular relevance for the nanomagnetism of discrete systems such as quantum dot arrays, due to the degenerate levels at midspectrum. While for the Hubbard interaction model-and even number of sites-the ground state spin is given by the Lieb theorem, the inclusion of long-range interaction-or odd number of sites-makes the spin state not known a priori, which justifies our approach. We calculate also the excitation energies, which are of experimental importance, and find significant variation induced by the interaction potential. One obtains insights on the mechanisms involved that impose as ground state the Lieb state with lower spin rather than the Hund one with maximum spin for the degenerate levels, showing this in the first and second orders of the interaction potential for the smaller lattices. The analytical results agree with the numerical ones, which are performed by exact diagonalization calculations or by a combined mean-field and configuration interaction method. While the Lieb state is always lower in energy than the Hund state, for strong long-range interaction, when possible, another minimal spin state is imposed as ground state.