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Oliver Oeckler

Publications and source records attributed to Oliver Oeckler.

10 recordsLinked to original sources
PubMed2006

Crystal structure, physical properties and HRTEM investigation of the new oxonitridosilicate EuSi2O2N2.

The new layered oxonitridosilicate EuSi(2)O(2)N(2) has been synthesized in a radio-frequency furnace at temperatures of about 1400 degrees C starting from europium(III) oxide (Eu(2)O(3)) and silicon diimide (Si(NH)(2)). The structure of the yellow material has been determined by single-crystal X-ray diffraction analysis (space group P1 (no. 1), a=709.5(1), b=724.6(1), c=725.6(1) pm, alpha=88.69(2), beta=84.77(2), gamma=75.84(2) degrees ,V=360.19(9)x10(6) pm(3), Z=4, R1=0.0631, 4551 independent reflections, 175 parameters). Its anionic Si(2)O(2)N(2) (2-) layers consist of corner-sharing SiON(3) tetrahedra with threefold connecting nitrogen and terminal oxygen atoms. High-resolution transmission electron micrographs indicate both ordered and disordered crystallites as well as twinning. Magnetic susceptibility measurements of EuSi(2)O(2)N(2) exhibit Curie-Weiss behavior above 20 K with an effective magnetic moment of 7.80(5) mu(B) Eu(-1), indicating divalent europium. Antiferromagnetic ordering is detected at 4.5(2) K. EuSi(2)O(2)N(2) shows a field-induced transition with a critical field of 0.50(5) T. The four crystallographically different europium sites cannot be distinguished by (151)Eu Mössbauer spectroscopy. The room-temperature spectrum is fitted by one signal at an isomer shift of delta=-12.3(1) mm s(-1) subject to quadrupole splitting of DeltaE(Q)=-2.3(1) mm s(-1) and an asymmetry parameter of 0.46(3). Luminescence measurements show a narrow emission band with regard to the four crystallographic europium sites with an emission maximum at lambda=575 nm.

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PubMed2006

Synthesis and properties of the first Möbius annulenes.

Heilbronner in 1964 predicted that annulenes with ".. a planar perimeter of N=4r AO's, which would yield an open shell configuration when occupied by 4r electrons, can be twisted into a closed shell Möbius strip perimeter without loss in pi electron energy". We have been able to synthesize the first [4n]annulene with such a Möbius topology and now present further Möbius isomers and the details of their preparation as stable compounds. To address the question whether the twist in the pi system has an effect on the properties we systematically investigate energy, geometry and magnetic parameters of a large number isomers of [16]annulenes. The Möbius twisted annulenes are consistently more aromatic than the non-twisted isomers. This is true for the parent as well as our benzoannelated systems. Our results are in contrast to those published recently by C. Castro, W. L. Karney, P. von R. Schleyer et al.

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PubMed2003

Ce10Cl4Ga5 and Ln3ClGa4 (Ln = La, Ce): reduced halides or oxidized intermetallics?

The compounds Ce(10)Cl(4)Ga(5) and Ln(3)ClGa(4) (Ln = La, Ce) were synthesized from stoichiometric mixtures of Ln, LnCl(3), and Ga under Ar atmosphere in sealed Ta ampules at 910-1020 degrees C for 25-26 days. Ce(10)Cl(4)Ga(5) is isostructural to La(10)Cl(4)Ga(5) (space group I4/mcm, No. 140) with lattice constants a = 7.9546(11) A, c = 31.793(6) A. Ln(3)ClGa(4) represents a new structural type, also in the space group I4/mcm, with a = 8.1955(8) and 8.1123(11) A, c = 11.363(2) and 11.229(2) A, respectively, for Ln = La and Ce. Ce(10)Cl(4)Ga(5) features building blocks of Ga-centered Ce(6) trigonal prisms and distinctive two-dimensional intermetallic CuAl(2) and U(3)Si(2) type nets. Its electronic structure falls within the realm of reduced rare-earth halides. Ln(3)ClGa(4) also contains the intermetallic CuAl(2) type nets, but the interstitials are inverted: The building blocks are Cl-centered Ln(6) octahedra. Its electronic structure is characterized by strong peripheral Ln-Ga bonding stabilizing the Ln(6)Cl octahedron which normally would have its Ln-Ln antibonding orbitals filled with electrons from interstitials beyond chalcogen. Magnetic susceptibility and conductivity measurements confirm the metallic nature of all three compounds.

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PubMed2002

Twinning and intergrowth of rare earth boride carbides.

Twins and intergrown crystals of tetragonal rare earth boride carbides, especially those with the La(5)B(2)C(6) structure type, have been investigated by high-resolution electron microscopy and X-ray diffraction. The structure of the twin interface has been determined. It provides an explanation for coherently intergrown domains of different structure. The Sc(3)C(4) structure type is remarkable because it is frequently intergrown with La(5)B(2)C(6)-type phases. It provides, for instance, a model for the intergrowth of other types, e.g. Gd(4)B(3)C(4) and Gd(5)B(2)C(5). The presence of metal-atom square nets in different orientations in the structures accounts for a number of intergrowth phenomena. The possibilities and limitations of X-ray structure determinations are discussed with respect to actual examples.

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PubMed1999

Y(21)I(18)C(14)B(7): Synthesis, Average Structure, and Structural Misfit.

The new compound Y(21)I(18)C(14)B(7) was prepared from YI(3), Y, C, and B at 1450 K. The average crystal structure was determined from single-crystal X-ray data. The structure consists of pseudoorthorhombic twisted metal atom double layers containing quasi-molecular CBC units. These are sandwiched by pseudohexagonal iodine layers. Owing to the symmetry and metric misfit the structure must be described with a large triclinic unit cell (space group P&onemacr;, a = 10.660(2) Å, b = 15.546(3) Å, c = 18.416(3) Å, alpha = 82.49(2) degrees, beta = 85.01(2) degrees, gamma = 82.92(2) degrees, Z = 2), which is probably only a good space-averaged approximation. Significant deviations from the averaged structure are indicated by unusual displacement parameters and the results of high-resolution electron microscopy.

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