| 1. |
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| 2. |
- Pal, Somnath, et al.
(författare)
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Effect of anti-site disorder on magnetism in La2NiMnO6
- 2018
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Ingår i: Physical Review B. - 2469-9950 .- 2469-9969. ; 97:16
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Tidskriftsartikel (refereegranskat)abstract
- La2NiMnO6 has been reported to exhibit a paramagnetic to ferromagnetic transition with a transition temperature of similar to 260 K. However, most of its magnetic properties, such as the saturation magnetization and even the transition temperature, appear to vary considerably among different reports. This is possibly because the crystallographic structure as well as the extent of the anti-site disorder (ASD) at the Ni/Mn sites are strongly influenced by the choice of synthesis routes. There are diverse reports connecting the extent of ASD to the valencies of Ni and Mn ions, such as Ni2+-Mn4+ and Ni3+-Mn3+, including suggestions of thermally induced valence transitions. Consequently, these reports arrive at very different conclusions on the mechanism behind the magnetic properties of La2NiMnO6. To address the correlation between ASD and valency, we have carried out a comparative study of two monoclinic La2NiMnO6 polycrystals with different degrees of ASD. Using a combination of x-ray absorption spectroscopy, x-raymagnetic circular dichroism, andmagnetometry, we conclude that the valency of the transition metal ions, and the transition temperature, are insensitive to the extent of ASD. However, we find the magnetic moment decreases strongly with an increasing ASD. We attribute this effect to the introduction of antiferromagnetic interactions in the anti-site disordered regions.
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| 3. |
- Pal, Somnath, et al.
(författare)
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Peculiar magnetic states in the double perovskite Nd2NiMnO6
- 2019
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Ingår i: Physical Review B. - : American Physical Society. - 2469-9950 .- 2469-9969. ; 100:4
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Tidskriftsartikel (refereegranskat)abstract
- We present magnetic measurements on Nd2NiMnO6 which exhibits a well-known insulating paramagnetic state to an insulating ferromagnetic state transition when cooled below 200 K. Beyond this basic fact, there is a great deal of diversity in the reported magnetic properties and interpretation of specific anomalies observed in the magnetic data of this compound below the Curie temperature. We address specifically two anomalies discussed in the past, namely, a spin-glass like behavior observed in some samples near 100 K and a downturn in the magnetization with a lowering of the temperature below approximately 50 K. We show for the first time that the application of an increasing magnetic field can systematically change the low-temperature behavior to make the down-turn in the magnetization into an upturn. With the help of first principle calculations and extensive simulations along with our experimental observations, we provide a microscopic understanding of all magnetic properties observed in this interesting system to point out that the glassiness around 100 K is absent in well-ordered samples and that the low-temperature magnetic anomaly below 50 K is a consequence of a ferromagnetic coupling of the Nd spin moments with the spin of the Ni-Mn ordered sublattice without giving rise to any ordering of the Nd sublattice that remains paramagnetic, contrary to earlier claims. We explain this counter-intuitive interpretation of a ferromagnetic coupling of Nd spins with Ni-Mn spin giving rise to a decrease in the total magnetic moment by noting the less than half-filled 4f occupation of Nd that ensures orbital and spin moments of Nd to be opposite to each other due to the spin-orbit coupling. Since the ground state total magnetic moment of Nd has a contribution from the orbital moment, that is larger than the spin moment, the total moment of Nd is indeed pointing in a direction opposite to the direction of spin moments of the Ni-Mn sublattice as a consequence of the ferromagnetic exchange coupling between Nd and Ni-Mn spins.
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| 4. |
- Jana, Somnath, et al.
(författare)
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Doping induced site-selective Mott insulating phase in LaFeO3
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Annan publikation (övrigt vetenskapligt/konstnärligt)abstract
- Tailoring transport properties of strongly correlated electron systems in a controlled fashion counts among the dreams of materials scientists. In copper oxides, vary- ing the carrier concentration is a tool to obtain high- temperature superconducting phases. In manganites, dop- ing results in exotic physics such as insulator-metal tran- sitions (IMT), colossal magnetoresistance (CMR), orbital- or charge-ordered (CO) or charge-disproportionate (CD) states. In most oxides, antiferromagnetic order and CD phase is asssociated with insulating behavior. Here we re- port the realization of a unique physical state that can be induced by Mo doping in LaFeO3: the resulting metallic state is a site-selective Mott insulator where itinerant elec- trons evolving on low-energy Mo states coexist with local- ized carriers on the Fe sites. In addition, a local breathing- type lattice distortion induces charge disproportionation on the latter, without destroying the antiferromagnetic order. A state, combining antiferromangetism, metallic- ity and CD phenomena is rather rare in oxides and have utmost significance for future antiferromagnetic memory devices.
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| 5. |
- Krieger, Jonas A., et al.
(författare)
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Weyl spin-momentum locking in a chiral topological semimetal
- 2024
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Ingår i: Nature Communications. - 2041-1723. ; 15:1
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Tidskriftsartikel (refereegranskat)abstract
- Spin-orbit coupling in noncentrosymmetric crystals leads to spin-momentum locking – a directional relationship between an electron’s spin angular momentum and its linear momentum. Isotropic orthogonal Rashba spin-momentum locking has been studied for decades, while its counterpart, isotropic parallel Weyl spin-momentum locking has remained elusive in experiments. Theory predicts that Weyl spin-momentum locking can only be realized in structurally chiral cubic crystals in the vicinity of Kramers-Weyl or multifold fermions. Here, we use spin- and angle-resolved photoemission spectroscopy to evidence Weyl spin-momentum locking of multifold fermions in the chiral topological semimetal PtGa. We find that the electron spin of the Fermi arc surface states is orthogonal to their Fermi surface contour for momenta close to the projection of the bulk multifold fermion at the Γ point, which is consistent with Weyl spin-momentum locking of the latter. The direct measurement of the bulk spin texture of the multifold fermion at the R point also displays Weyl spin-momentum locking. The discovery of Weyl spin-momentum locking may lead to energy-efficient memory devices and Josephson diodes based on chiral topological semimetals.
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| 6. |
- Lindblad, Rebecka, et al.
(författare)
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Electronic Structure of CH3NH3PbX3 Perovskites : Dependence on the Halide Moiety
- 2015
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Ingår i: The Journal of Physical Chemistry C. - American Chemical Society : American Chemical Society (ACS). - 1932-7447 .- 1932-7455. ; 119:4, s. 1818-1825
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Tidskriftsartikel (refereegranskat)abstract
- A combination of measurements using photoelectron spectroscopy and calculations using density functional theory (DFT) was applied to compare the detailed electronic structure of the organolead halide perovskites CH3NH3PbI3 and CH3NH3PbBr3. These perovskite materials are used to absorb light in mesoscopic and planar heterojunction solar cells. The Pb 4f core level is investigated to get insight into the chemistry of the two materials. Valence level measurments are also included showing a shift of the valence band edges where there is a higher binding energy of the edge for the CH3NH3PbBr3 perovskite. These changes are supported by the theoretical calculations which indicate that the differences in electronic structure are mainly caused by the nature of the halide ion rather than structural differences. The combination of photoelectron spectroscopy measurements and electronic structure calculations is essential to disentangle how the valence band edge in organolead halide perovskites is governed by the intrinsic difference in energy levels of the halide ions from the influence of chemical bonding.
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| 7. |
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| 8. |
- Mukherjee, Sumanta, et al.
(författare)
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Origin and distribution of charge carriers in LaAlO3-SrTiO3 oxide heterostructures in the high carrier density limit
- 2016
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Ingår i: PHYSICAL REVIEW B. - 2469-9950. ; 93:24
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Tidskriftsartikel (refereegranskat)abstract
- Using hard x-ray photoelectron spectroscopywith variable photon energy (2-8 keV), we address the distribution of charge carriers in the prototypical LaAlO3 (LAO) and SrTiO3 (STO) oxide heterostructures with high carrier densities (10(17) cm(-2)). Our results demonstrate the presence of two distinct charge distributions in this system: one tied to the interface with a similar to 1-nm width and similar to 2-5 x 10(14)-cm(-2) carrier concentration, while the other appears distributed nearly homogeneously through the bulk of STO corresponding to a much larger carrier contribution. Our results also establish bimodal oxygen vacancies, namely on top of LAO and throughout STO, quantitatively establishing these as the origin of the observed bimodal depth distribution of charge carriers in these highly doped sample.
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| 9. |
- Panda, Swarup K., et al.
(författare)
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High photon energy spectroscopy of NiO : Experiment and theory
- 2016
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Ingår i: PHYSICAL REVIEW B. - 2469-9950. ; 93:23
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Tidskriftsartikel (refereegranskat)abstract
- We have revisited the valence band electronic structure of NiO by means of hard x-ray photoemission spectroscopy (HAXPES) together with theoretical calculations using both the GW method and the local density approximation + dynamical mean-field theory (LDA+DMFT) approaches. The effective impurity problem in DMFT is solved through the exact diagonalization (ED) method. We show that the LDA+DMFT method in conjunction with the standard fully localized limit (FLL) and around mean field (AMF) double-counting alone cannot explain all the observed structures in the HAXPES spectra. GW corrections are required for the O bands and Ni-s and p derived states to properly position their binding energies. Our results establish that a combination of the GW and DMFT methods is necessary for correctly describing the electronic structure of NiO in a proper ab initio framework. We also demonstrate that the inclusion of photoionization cross section is crucial to interpret the HAXPES spectra of NiO. We argue that our conclusions are general and that the here suggested approach is appropriate for any complex transition metal oxide.
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| 10. |
- Sarkar, Debasish, et al.
(författare)
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A Cost-Effective and High-Performance Core-Shell-Nanorod-Based ZnO/alpha-Fe2O3//ZnO/C Asymmetric Supercapacitor
- 2017
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Ingår i: Journal of the Electrochemical Society. - : ELECTROCHEMICAL SOC INC. - 0013-4651 .- 1945-7111. ; 164:6, s. A987-A994
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Tidskriftsartikel (refereegranskat)abstract
- A novel core-shell design for nano-structured electrode materials is introduced for realizing cost-effective and high-performance supercapacitors. In the proposed core-shell design, thin shell-layers of highly pseudo-capacitive materials provide the platform for surface or near-surface-based faradaic and non-faradaic reactions together with shortened ion-diffusion path facilitating fast-ion intercalation and deintercalation processes. The highly-conducting core serves as highway for fast electron transfer toward current collectors, improving both energy and power performance characteristics of the core-shell structure in relation to pristine component materials. Furthermore, use of carbon (C)-based materials as a shell layer in either electrode not only enhances capacitive performance through double-layer formation but also provides enough mechanical strength to sustain volume changes in the core material during long-cycling of the supercapacitor improving its cycle life. In order to enhance electrochemical performance in terms of specific capacitance and rate capability via core-shell architecture and nano-structuring, an asymmetric supercapacitor (ASC) is assembled using ZnO/alpha-Fe2O3 and ZnO/C core-shell nanorods as respective negative and positive electrodes. The ASC exhibits a specific capacitance of similar to 115 F/g at a scan rate of 10 mV/s in a potential window as large as 1.8 V with a response time as short as 39 ms and retains more than 80% of its initial capacitance after 4000 cycles. Interestingly, the ASC can deliver an energy density of similar to 41 Wh/kg and a power density of similar to 7 kW/kg that are significantly higher than those reported hitherto for iron-oxide-based ASCs.
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