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Crystal structure of diethyl (E)-2-[(benzofuran-2-yl)methylidene]succinate

2015, Schirmer, Marie-Luis, Spannenberg, Anke, Werner, Thomas

The title compound, C17H18O5, was synthesized by a base-free catalytic Wittig reaction. The mol­ecule consists of a diethyl itaconate unit, which is connected via the C=C double bond to a benzo­furan moiety. The benzo­furan ring system (r.m.s. deviation = 0.007 Å) forms dihedral angles of 79.58 (4) and 12.12 (10)° with the mean planes through the cis and trans eth­oxy­carbonyl groups, respectively. An intra­molecular C-H...O hydrogen bond involving the O atom of the benzo­furan moiety is observed. In the crystal, mol­ecules are linked into ribbons running parallel to the b axis by C-H...O hydrogen bonds.

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Crystal structure of (E)-undec-2-enoic acid

2015, Sonneck, Marcel, Peppel, Tim, Spannenberg, Anke, Wohlrab, Sebastian

In the mol­ecule of the title low-melting [alpha],[beta]-unsaturated carb­oxy­lic acid, C11H20O2, the least-squares mean line through the octyl chain forms an angle of 60.10 (13)° with the normal to plane of the acrylic acid fragment (r.m.s. deviation = 0.008 Å). In the crystal, centrosymmetrically related mol­ecules are linked by pairs of O-H...O hydrogen bonds into dimers, forming layers parallel to the (041) plane.

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Resistive switching in polycrystalline YMnO3 thin films

2014, Bogusz, A., Müller, A.D., Blaschke, D., Skorupa, I., Bürger, D., Scholz, A., Schmidt, O.G., Schmidt, H.

We report a unipolar, nonvolatile resistive switching in polycrystalline YMnO3 thin films grown by pulsed laser deposition and sandwiched between Au top and Ti/Pt bottom electrodes. The ratio of the resistance in the OFF and ON state is larger than 103. The observed phenomena can be attributed to the formation and rupture of conductive filaments within the multiferroic YMnO3 film. The generation of conductive paths under applied electric field is discussed in terms of the presence of grain boundaries and charged domain walls inherently formed in hexagonal YMnO3. Our findings suggest that engineering of the ferroelectric domains might be a promising route for designing and fabrication of novel resistive switching devices.

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Crystal structure of bis(η5-cyclopenta-dienyl)(2, 3-diethylbutane-1, 4-diyl)-hafnium(IV)

2015, Burlakov, Vladimir V., Baumann, Wolfgang, Arndt, Perdita, Spannenberg, Anke, Rosenthal, Uwe

The title compound, [Hf(C5H5)2(C8H16)], proves a structural motif of hafna­cyclo­pentane besides the coordination of two cyclo­penta­dienyl ligands in an [eta]5-fashion. The hafna­cyclo­pentane ring has a twist conformation and is substituted by two ethyl groups in the [beta],[beta]'-positions, which are trans orientated to each other. One cyclo­penta­dienyl ring and one ethyl group are each disordered over two positions with site-occupancy ratios of 0.679 (15):0.321 (15) and 0.702 (18):0.298 (18), respectively.

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Crystal structure of bis{μ2-[(2-iminocyclopentylidene)methylidene]azanido-κ2 N:N'}bis[(η5-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate

2015, Becker, Lisanne, Spannenberg, Anke, Arndt, Perdita, Rosenthal, Uwe

The title compound, [Zr2(C10H15)4(C6H6N2)2]·C6H14, was obtained by the stoichiometric reaction of adipo­nitrile with [Zr(C10H15)2([eta]2-Me3SiC2SiMe3)]. Intra­molecular nitrile-nitrile couplings and deprotonation of the substrate produced the (1-imino-2-enimino)­cyclo­pentane ligand, which functions as a five-membered bridge between the two metal atoms. The ZrIV atom exhibits a distorted tetra­hedral coordination sphere defined by two penta­methyl­cyclo­penta­dienyl ligands, by the imino unit of one (1-imino-2-enimino)­cyclo­pentane and by the enimino unit of the second (1-imino-2-enimino)­cyclo­pentane. The cyclo­pentane ring of the ligand shows an envelope conformation. The asymmetric unit contains one half of the complex and one half of the hexane solvent mol­ecule, both being completed by the application of inversion symmetry. One of the penta­methyl­cyclo­penta­dienyl ligands is disordered over two sets of sites with a refined occupancy ratio of 0.8111 (3):0.189 (3). In the crystal, the complex mol­ecules are packed into rods extending along [100], with the solvent mol­ecules located in between. The rods are arranged in a distorted hexa­gonal packing.

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Crystal structure of di-n-but­yl­bis­([eta]5-penta­methyl­cyclo­penta­dien­yl)hafnium(IV)

2015, Arndt, Perdita, Schubert,Kathleen, Burlakov, Vladimir V., Spannenberg, Anke, Rosenthal, Uwe

The crystal structure of the title compound, [Hf(C10H15)2(C4H9)2], reveals two independent mol­ecules in the asymmetric unit. The diffraction experiment was performed with a racemically twinned crystal showing a 0.529 (5):0.471 (5) component ratio. Each HfIV atom is coordinated by two penta­methyl­cyclo­penta­dienyl and two n-butyl ligands in a distorted tetra­hedral geometry, with the cyclo­penta­dienyl rings inclined to one another by 45.11 (15) and 45.37 (16)°. In contrast to the isostructural di(n-butyl)bis([eta]5-penta­methyl­cyclo­penta­dien­yl)zirconium(IV) complex with a noticeable difference in the Zr-butyl bonding, the Hf-Cbut­yl bond lengths differ from each other by no more than 0.039 (3) Å.

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Schottky contacts to In2O3

2014, von Wenckstern, H., Splith, D., Schmidt, F., Grundmann, M., Bierwagen, O., Speck, J.S.

n-type binary compound semiconductors such as InN, InAs, or In2O3 are especial because the branch-point energy or charge neutrality level lies within the conduction band. Their tendency to form a surface electron accumulation layer prevents the formation of rectifying Schottky contacts. Utilizing a reactive sputtering process in an oxygen-containing atmosphere, we demonstrate Schottky barrier diodes on indium oxide thin films with rectifying properties being sufficient for space charge layer spectroscopy. Conventional non-reactive sputtering resulted in ohmic contacts. We compare the rectification of Pt, Pd, and Au Schottky contacts on In2O3 and discuss temperature-dependent current-voltage characteristics of Pt/In2O3 in detail. The results substantiate the picture of oxygen vacancies being the source of electrons accumulating at the surface, however, the position of the charge neutrality level and/or the prediction of Schottky barrier heights from it are questioned.

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Crystal structure of (E)-dodec-2-enoic acid

2015, Sonneck, Marcel, Peppel, Tim, Spannenberg, Anke, Wohlrab, Sebastian

The crystal structure of (E)-dodec-2-enoic acid, C12H22O2, an [alpha],[beta]-unsaturated carb­oxy­lic acid with a melting point (295 K) near room temperature, is characterized by carb­oxy­lic acid inversion dimers linked by pairs of O-H...O hydrogen bonds. The carb­oxy­lic acid group and the following three carbon atoms of the chain of the (E)-dodec-2-enoic acid mol­ecule lie almost in one plane (r.m.s. deviation for the four C atoms and two O atoms = 0.012 Å), whereas the remaining carbon atoms of the hydro­carbon chain adopt a nearly fully staggered conformation [moduli of torsion angles vary from 174.01 (13) to 179.97 (13)°].

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Raman imaging to study structural and chemical features of the dentin enamel junction

2015, Alebrahim, M.A., Krafft, C., Popp, J., El-Khateeb, Mohammad Y.

The structure and chemical features of the human dentin enamel junction (DEJ) were characterized using Raman spectroscopic imaging. Slices were prepared from 10 German, and 10 Turkish teeth. Raman images were collected at 785 nm excitation and the average Raman spectra were calculated for analysis. Univariate and multivariate spectral analysis were applied for investigation. Raman images were obtained based on the intensity ratios of CH at 1450 cm-1 (matrix) to phosphate at 960 cm-1 (mineral), and carbonate to phosphate (1070/960) ratios. Different algorithms (HCA, K-means cluster and VCA) also used to study the DEJ. The obtained results showed that the width of DEJ is about 5 pm related to univariate method while it varies from 6 to 12 μm based on multivariate spectral technique. Both spectral analyses showed increasing in carbonate content inside the DEJ compared to the dentin, and the amide I (collagen) peak in dentin spectra is higher than DEJ spectra peak.

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Hybrid Optical Fibers – An Innovative Platform for In‐Fiber Photonic Devices

2015, Alexander Schmidt, Markus, Argyros, Alexander, Sorin, Fabien

The field of hybrid optical fibers is one of the most active research areas in current fiber optics and has the vision of integrating sophisticated materials inside fibers, which are not traditionally used in fiber optics. Novel in-fiber devices with unique properties have been developed, opening up new directions for fiber optics in fields of critical interest in modern research, such as biophotonics, environmental science, optoelectronics, metamaterials, remote sensing, medicine, or quantum optics. Here the recent progress in the field of hybrid optical fibers is reviewed from an application perspective, focusing on fiber-integrated devices enabled by including novel materials inside polymer and glass fibers. The topics discussed range from nanowire-based plasmonics and hyperlenses, to integrated semiconductor devices such as optoelectronic detectors, and intense light generation unlocked by highly nonlinear hybrid waveguides.