2,159 research outputs found

    Chalcogen-height dependent magnetic interactions and magnetic order switching in FeSex_xTe1x_{1-x}

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    Magnetic properties of iron chalcogenide superconducting materials are investigated using density functional calculations. We find the stability of magnetic phases is very sensitive to the height of chalcogen species from the Fe plane: while FeTe with optimized Te height has the double-stripe-type (π,0)(\pi,0) magnetic ordering, the single-stripe-type (π,π)(\pi,\pi) ordering becomes the ground state phase when Te height is lowered below a critical value by, e.g., Se doping. This behavior is understood by opposite Te-height dependences of the superexchange interaction and a longer-range magnetic interaction mediated by itinerant electrons. We also demonstrate a linear temperature dependence of the macroscopic magnetic susceptibility in the single-stripe phase in contrast to a constant behavior in the double-stripe phase. Our findings provide a comprehensive and unified view to understand the magnetism in FeSex_xTe1x_{1-x} and iron pnictide superconductors.Comment: 4 pages, 4 figure

    Enhanced spin density wave in LaOFeSb

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    We predict atomic, electronic, and magnetic structures of a hypothetical compound LaOFeSb by first-principles density-functional calculations. It is shown that LaOFeSb prefers a stripe-type antiferromagnetic phase (i.e., spin density wave (SDW) phase) to the non-magnetic (NM) phase, with a larger Fe spin moment and greater SDW-NM energy difference than those of LaOFeAs. The SDW phase is found to favor the orthorhombic structure while the tetragonal structure is more stable in the NM phase. In the NM-phase LaOFeSb, the electronic bandwidth near the Fermi energy is reduced compared with LaOFeAs, indicating smaller orbital overlap between Fe dd states and subsequently enhanced intra-atomic exchange coupling. The calculated Fermi surface in the NM phase consists of three hole and two electron sheets, and shows increased nesting between two hole and two electron sheets compared with LaOFeAs. Monotonous changes found in our calculated material properties of LaOFePn (Pn=P, As, and Sb), along with reported superconducting properties of doped LaOFeP and LaOFeAs, suggest that doped LaOFeSb may have a higher superconducting transition temperature.Comment: 5 pages with 3 figures and 1 table, double colum

    Low-velocity anisotropic Dirac fermions on the side surface of topological insulators

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    We report anisotropic Dirac-cone surface bands on a side-surface geometry of the topological insulator Bi2_2Se3_3 revealed by first-principles density-functional calculations. We find that the electron velocity in the side-surface Dirac cone is anisotropically reduced from that in the (111)-surface Dirac cone, and the velocity is not in parallel with the wave vector {\bf k} except for {\bf k} in high-symmetry directions. The size of the electron spin depends on the direction of {\bf k} due to anisotropic variation of the noncollinearity of the electron state. Low-energy effective Hamiltonian is proposed for side-surface Dirac fermions, and its implications are presented including refractive transport phenomena occurring at the edges of tological insulators where different surfaces meet.Comment: 4 pages, 2 columns, 4 figure

    Skin care benefits of bioactive compounds isolated from Zanthoxylum piperitum DC. (Rutaceae)

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    Purpose: To investigate skin care efficacies of Zanthoxylum pipetitum extract and isolated compounds. Methods: Ethanol extracts of leaves, branches and fruits of what were partitioned into n-hexane, chloroform, ethyl acetate, n-butanol and aqueous layers and some fractions were further analyzed to isolate five compounds. The isolated compounds were identified based on the proton and carbon nuclear magnetic resonance (NMR) spectra. Cosmetic efficacy tests of the extracts and isolated compounds were evaluated by in vitro tests. Results: Phytochemical studies of the chloroform and ethyl acetate layers led to the isolation of five compounds; quercitrin (1), afzelin (2), hydroxy-α-sanshool (3), α-sanshool (4) and hyperoside (5). In activity tests, the extracts showed inhibitory activity against inflammation response and melanin synthesis, and induction of procollagen type I C-peptide (PIP). Among the isolated compounds, hydroxy-α-sanshool (3) and α-sanshool (4) displayed significant anti-inflammatory activity. Conclusion: The results demonstrate that Z. piperitum extract and its active compounds possess a significant potential as a cosmeeutical agent for enhancing skin quality

    Imbalanced loss-integrated deep-learning-based ultrasound image analysis for diagnosis of rotator-cuff tear

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    A rotator cuff tear (RCT) is an injury in adults that causes difficulty in moving, weakness, and pain. Only limited diagnostic tools such as magnetic resonance imaging (MRI) and ultrasound Imaging (UI) systems can be utilized for an RCT diagnosis. Although UI offers comparable performance at a lower cost to other diagnostic instruments such as MRI, speckle noise can occur the degradation of the image resolution. Conventional vision-based algorithms exhibit inferior performance for the segmentation of diseased regions in UI. In order to achieve a better segmentation for diseased regions in UI, deep-learning-based diagnostic algorithms have been developed. However, it has not yet reached an acceptable level of performance for application in orthopedic surgeries. In this study, we developed a novel end-to-end fully convolutional neural network, denoted as Segmentation Model Adopting a pRe-trained Classification Architecture (SMART-CA), with a novel integrated on positive loss function (IPLF) to accurately diagnose the locations of RCT during an orthopedic examination using UI. Using the pre-trained network, SMART-CA can extract remarkably distinct features that cannot be extracted with a normal encoder. Therefore, it can improve the accuracy of segmentation. In addition, unlike other conventional loss functions, which are not suited for the optimization of deep learning models with an imbalanced dataset such as the RCT dataset, IPLF can efficiently optimize the SMART-CA. Experimental results have shown that SMART-CA offers an improved precision, recall, and dice coefficient of 0.604% (+38.4%), 0.942% (+14.0%) and 0.736% (+38.6%) respectively. The RCT segmentation from a normal ultrasound image offers the improved precision, recall, and dice coefficient of 0.337% (+22.5%), 0.860% (+15.8%) and 0.484% (+28.5%), respectively, in the RCT segmentation from an ultrasound image with severe speckle noise. The experimental results demonstrated the IPLF outperforms other conventional loss functions, and the proposed SMART-CA optimized with the IPLF showed better performance than other state-of-the-art networks for the RCT segmentation with high robustness to speckle noise. © 2021 by the authors. Licensee MDPI, Basel, Switzerland.1
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