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- ItemDetection of antiskyrmions by topological Hall effect in Heusler compounds(Woodbury, NY : Inst., 2020) Kumar, Vivek; Kumar, Nitesh; Reehuis, Manfred; Gayles, Jacob; Sukhanov, A.S.; Hoser, Andreas; Damay, Françoise; Shekhar, Chandra; Adler, Peter; Felser, ClaudiaHeusler compounds having D2d crystal symmetry gained much attention recently due to the stabilization of a vortexlike spin texture called antiskyrmions in thin lamellae of Mn1.4Pt0.9Pd0.1Sn as reported in the work of Nayak et al. [Nature (London) 548, 561 (2017)10.1038/nature23466]. Here we show that bulk Mn1.4Pt0.9Pd0.1Sn undergoes a spin-reorientation transition from a collinear ferromagnetic to a noncollinear configuration of Mn moments below 135 K, which is accompanied by the emergence of a topological Hall effect. We tune the topological Hall effect in Pd and Rh substituted Mn1.4PtSn Heusler compounds by changing the intrinsic magnetic properties and spin textures. A unique feature of the present system is the observation of a zero-field topological Hall resistivity with a sign change which indicates the robust formation of antiskyrmions. © 2020 authors. Published by the American Physical Society.
- ItemDeep neural networks for classifying complex features in diffraction images(Woodbury, NY : Inst., 2019) Zimmermann, Julian; Langbehn, Bruno; Cucini, Riccardo; Di Fraia, Michele; Finetti, Paola; LaForge, Aaron C.; Nishiyama, Toshiyuki; Ovcharenko, Yevheniy; Piseri, Paolo; Plekan, Oksana; Prince, Kevin C.; Stienkemeier, Frank; Ueda, Kiyoshi; Callegari, Carlo; Möller, Thomas; Rupp, DanielaIntense short-wavelength pulses from free-electron lasers and high-harmonic-generation sources enable diffractive imaging of individual nanosized objects with a single x-ray laser shot. The enormous data sets with up to several million diffraction patterns present a severe problem for data analysis because of the high dimensionality of imaging data. Feature recognition and selection is a crucial step to reduce the dimensionality. Usually, custom-made algorithms are developed at a considerable effort to approximate the particular features connected to an individual specimen, but because they face different experimental conditions, these approaches do not generalize well. On the other hand, deep neural networks are the principal instrument for today's revolution in automated image recognition, a development that has not been adapted to its full potential for data analysis in science. We recently published [Langbehn et al., Phys. Rev. Lett. 121, 255301 (2018)] the application of a deep neural network as a feature extractor for wide-angle diffraction images of helium nanodroplets. Here we present the setup, our modifications, and the training process of the deep neural network for diffraction image classification and its systematic bench marking. We find that deep neural networks significantly outperform previous attempts for sorting and classifying complex diffraction patterns and are a significant improvement for the much-needed assistance during postprocessing of large amounts of experimental coherent diffraction imaging data.
- ItemAb initio theory of plasmonic superconductivity within the Eliashberg and density-functional formalisms(Woodbury, NY : Inst., 2020) Davydov, A.; Sanna, A.; Pellegrini, C.; Dewhurst, J.K.; Sharma, S.; Gross, E.K.U.We extend the two leading methods for the ab initio computational description of phonon-mediated superconductors, namely Eliashberg theory and density-functional theory for superconductors (SCDFT), to include plasmonic effects. Furthermore, we introduce a hybrid formalism in which the Eliashberg approximation for the electron-phonon coupling is combined with the SCDFT treatment of the dynamically screened Coulomb interaction. The methods have been tested on a set of well-known conventional superconductors by studying how the plasmon contribution affects the phononic mechanism in determining the critical temperature (TC). Our simulations show that plasmonic SCDFT leads to a good agreement between predicted and measured TC's, whereas Eliashberg theory considerably overestimates the plasmon-mediated pairing and, therefore, TC. The hybrid approach, on the other hand, gives results close to SCDFT and overall in excellent agreement with experiments.
- ItemStrong anisotropy of the electron-phonon interaction in NbP probed by magnetoacoustic quantum oscillations(Woodbury, NY : Inst., 2020) Schindler, Clemens; Gorbunov, Denis; Zherlitsyn, Sergei; Galeski, Stanislaw; Schmidt, Marcus; Wosnitza, Jochen; Gooth, JohannesIn this study, we report on the observation of de Haas-van Alphen-type quantum oscillations (QOs) in the ultrasound velocity of NbP as well as "giant QOs"in the ultrasound attenuation in pulsed magnetic fields. The difference in the QO amplitude for different acoustic modes reveals a strong anisotropy of the effective deformation potential, which we estimate to be as high as 9eV for certain parts of the Fermi surface. Furthermore, the natural filtering of QO frequencies and the tracing of the individual Landau levels to the quantum limit allows for a more detailed investigation of the Fermi surface of NbP, as was previously achieved by means of analyzing QOs observed in magnetization or electrical resistivity. © 2020 authors. Published by the American Physical Society.
- ItemBosonization in 2+1 dimensions via Chern-Simons bosonic particle-vortex duality(Woodbury, NY : Inst., 2020) Türker, Oğuz; Van den Brink, Jeroen; Meng, Tobias; Nogueira, Flavio S.Dualities provide deep insight into physics by relating two seemingly distinct theories. Here we consider a duality between lattice fermions and bosons in (2+1) spacetime dimensions, relating free massive Dirac fermions to Abelian Chern-Simons Higgs (ACSH) bosons. To establish the duality, we represent the exact partition function of the lattice fermions in terms of the writhe of fermionic worldlines. On the bosonic side, the partition function is expressed in the writhe of the vortex loops of the particle-vortex dual of the ACSH Lagrangian. In the continuum and scaling limit, we show these to be identical. This result can be understood from the closed fermionic worldlines being direct mappings of the ACSH vortex loops, with the writhe keeping track of particle statistics. © 2020 authors. Published by the American Physical Society. Published by the American Physical Society under the terms of the "https://creativecommons.org/licenses/by/4.0/"Creative Commons Attribution 4.0 International license. Further distribution of this work must maintain attribution to the author(s) and the published article's title, journal citation, and DOI. Funded by SCOAP3.
- ItemGuiding shear bands in bulk metallic glasses using stress fields : A perspective from the activation of flow units(Woodbury, NY : Inst., 2020) Kosiba, K.; Scudino, S.; Bednarcik, J.; Bian, J.; Liu, G.; Kühn, U.; Pauly, S.Controlling shear band propagation is the key to obtain ductile metallic glasses. Here, we use a residual stress field to vary the direction of shear band propagation. We ascribe this behavior to the effect of the stress field on the activation of shear transformation zones (STZs) along their characteristic direction and we quantify this contribution to the energy of the process. Because of the progressively adverse orientation of the stress field, the energy stored as shear in the STZ decreases to a level where shear band propagation at alternative angles becomes energetically more favorable. © 2020 authors.
- ItemGradual pressure-induced enhancement of magnon excitations in CeCoSi(Woodbury, NY : Inst., 2020) Nikitin, S.E.; Franco, D.G.; Kwon, J.; Bewley, R.; Podlesnyak, A.; Hoser, A.; Koza, M.M.; Geibel, C.; Stockert, O.CeCoSi is an intermetallic antiferromagnet with a very unusual temperature-pressure phase diagram: At ambient pressure it orders below TN=8.8K, while application of hydrostatic pressure induces a new magnetically ordered phase with exceptionally high transition temperature of ∼40K at 1.5 GPa. We studied the magnetic properties and the pressure-induced magnetic phase of CeCoSi by means of elastic and inelastic neutron scattering (INS) and heat capacity measurements. At ambient pressure CeCoSi orders into a simple commensurate AFM structure with a reduced ordered moment of only mCe=0.37(6)μB. Specific heat and low-energy INS indicate a significant gap in the low-energy magnon excitation spectrum in the antiferromagnetic phase, with the CEF excitations located above 10 meV. Hydrostatic pressure gradually shifts the energy of the magnon band towards higher energies and the temperature dependence of the magnons measured at 1.5 GPa is consistent with the phase diagram. Moreover, the CEF excitations are also drastically modified under pressure. © 2020 authors.
- ItemMeasurement of diamond nucleation rates from hydrocarbons at conditions comparable to the interiors of icy giant planets(Woodbury, NY : Inst., 2020) Schuster, A.K.; Hartley, N.J.; Vorberger, J.; Döppner, T.; Van Driel, T.; Falcone, R.W.; Fletcher, L.B.; Frydrych, S.; Galtier, E.; Gamboa, E.J.; Gericke, D.O.; Glenzer, S.H.; Granados, E.; MacDonald, M.J.; MacKinnon, A.J.; McBride, E.E.; Nam, I.; Neumayer, P.; Pak, A.; Prencipe, I.; Voigt, K.; Saunders, A.M.; Sun, P.; Kraus, D.We present measurements of the nucleation rate into a diamond lattice in dynamically compressed polystyrene obtained in a pump-probe experiment using a high-energy laser system and in situ femtosecond x-ray diffraction. Different temperature-pressure conditions that occur in planetary interiors were probed. For a single shock reaching 70 GPa and 3000 K no diamond formation was observed, while with a double shock driving polystyrene to pressures around 150 GPa and temperatures around 5000 K nucleation rates between 1029 and 1034m-3 s-1 were recorded. These nucleation rates do not agree with predictions of the state-of-the-art theoretical models for carbon-hydrogen mixtures by many orders of magnitude. Our data suggest that there is significant diamond formation to be expected inside icy giant planets like Neptune and Uranus. © 2020 authors. Published by the American Physical Society.
- ItemExtremely well isolated two-dimensional spin-1/2 antiferromagnetic Heisenberg layers with a small exchange coupling in the molecular-based magnet CuPOF(Woodbury, NY : Inst., 2020) Opherden, D.; Nizar, N.; Richardson, K.; Monroe, J.C.; Turnbull, M.M.; Polson, M.; Vela, S.; Blackmore, W.J.A.; Goddard, P.A.; Singleton, J.; Choi, E.S.; Xia, F.; Williams, R.C.; Lancaster, T.; Pratt, F.L.; Blundell, S.J.; Skourski, Y.; Uhlarz, M.; Ponomaryov, A.N.; Zvyagin, S.A.; Wosnitza, J.; Baenitz, M.; Heinmaa, I.; Stern, R.; Kühne, H.; Landee, C.P.We report on a comprehensive characterization of the newly synthesized Cu2+-based molecular magnet [Cu(pz)2(2-HOpy)2](PF6)2 (CuPOF), where pz=C4H4N2 and 2-HOpy=C5H4NHO. From a comparison of theoretical modeling to results of bulk magnetometry, specific heat, μ+SR, ESR, and NMR spectroscopy, this material is determined as an excellent realization of the two dimensional square-lattice S=12 antiferromagnetic Heisenberg model with a moderate intraplane nearest-neighbor exchange coupling of J/kB=6.80(5) K, and an extremely small interlayer interaction of about 1 mK. At zero field, the bulk magnetometry reveals a temperature-driven crossover of spin correlations from isotropic to XY type, caused by the presence of a weak intrinsic easy-plane anisotropy. A transition to long-range order, driven by the low-temperature XY anisotropy under the influence of the interlayer coupling, occurs at TN=1.38(2) K, as revealed by μ+SR. In applied magnetic fields, our H1-NMR data reveal a strong increase of the magnetic anisotropy, manifested by a pronounced enhancement of the transition temperature to commensurate long-range order at TN=2.8 K and 7 T. © 2020 authors.
- ItemTwo-dimensional electron gas of the In2O3 surface: Enhanced thermopower, electrical transport properties, and reduction by adsorbates or compensating acceptor doping(Woodbury, NY : Inst., 2020) Papadogianni, Alexandra; Rombach, Julius; Berthold, Theresa; Polyakov, Vladimir; Krischok, Stefan; Himmerlich, Marcel; Bierwagen, OliverIn2O3 is an n-type transparent semiconducting oxide possessing a surface electron accumulation layer (SEAL) like several other relevant semiconductors, such as InAs, InN, SnO2, and ZnO. Even though the SEAL is within the core of the application of In2O3 in conductometric gas sensors, a consistent set of transport properties of this two-dimensional electron gas (2DEG) is missing in the present literature. To this end, we investigate high-quality single-crystalline as well as textured doped and undoped In2O3(111) films grown by plasma-assisted molecular beam epitaxy to extract transport properties of the SEAL by means of Hall effect measurements at room temperature while controlling the oxygen adsorbate coverage via illumination. The resulting sheet electron concentration and mobility of the SEAL are ≈1.5×1013cm−2 and ≈150cm2/Vs, respectively, both of which are strongly reduced by oxygen-related surface adsorbates from the ambient air. Our transport measurements further demonstrate a systematic reduction of the SEAL by doping In2O3 with the deep compensating bulk acceptors Ni or Mg. This finding is supported by x-ray photoelectron spectroscopy (XPS) measurements of the surface band bending and SEAL electron emission. Quantitative analyses of these XPS results using self-consistent, coupled Schrödinger-Poisson calculations indicate the simultaneous formation of compensating bulk donor defects (likely oxygen vacancies), which almost completely compensate the bulk acceptors. Finally, an enhancement of the thermopower by reduced dimensionality is demonstrated in In2O3: Seebeck coefficient measurements of the surface 2DEG with partially reduced sheet electron concentrations between 3×1012 and 7×1012cm−2 (corresponding average volume electron concentration between 1×1019 and 2.3×1019cm−3) indicate a value enhanced by ≈80% compared to that of bulk Sn-doped In2O3 with comparable volume electron concentration.