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H. Dietrich

Publications and source records attributed to H. Dietrich.

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Regular subalgebras and nilpotent orbits of real graded Lie algebras

For a semisimple Lie algebra over the complex numbers, Dynkin (1952) developed an algorithm to classify the regular semisimple subalgebras, up to conjugacy by the inner automorphism group. For a graded semisimple Lie algebra over the complex numbers, Vinberg (1979) showed that a classification of a certain type of regular subalgebras (called carrier algebras) yields a classification of the nilpotent orbits in a homogeneous component of that Lie algebra. Here we consider these problems for (graded) semisimple Lie algebras over the real numbers. First, we describe an algorithm to classify the regular semisimple subalgebras of a real semisimple Lie algebra. This also yields an algorithm for listing, up to conjugacy, the carrier algebras in a real graded semisimple real algebra. We then discuss what needs to be done to obtain a classification of the nilpotent orbits from that; such classifications have applications in differential geometry and theoretical physics. Our algorithms are implemented in the language of the computer algebra system GAP, using our package CoReLG; we report on example computations.

math.RT

Oxygen adsorption on the Ru (10 bar 1 0) surface: Anomalous coverage dependence

Oxygen adsorption onto Ru (10 bar 1 0) results in the formation of two ordered overlayers, i.e. a c(2 times 4)-2O and a (2 times 1)pg-2O phase, which were analyzed by low-energy electron diffraction (LEED) and density functional theory (DFT) calculation. In addition, the vibrational properties of these overlayers were studied by high-resolution electron loss spectroscopy. In both phases, oxygen occupies the threefold coordinated hcp site along the densely packed rows on an otherwise unreconstructed surface, i.e. the O atoms are attached to two atoms in the first Ru layer Ru(1) and to one Ru atom in the second layer Ru(2), forming zigzag chains along the troughs. While in the low-coverage c(2 times 4)-O phase, the bond lengths of O to Ru(1) and Ru(2) are 2.08 A and 2.03 A, respectively, corresponding bond lengths in the high-coverage (2 times 1)-2O phase are 2.01 A and 2.04 A (LEED). Although the adsorption energy decreases by 220 meV with O coverage (DFT calculations), we observe experimentally a shortening of the Ru(1)-O bond length with O coverage. This effect could not be reconciled with the present DFT-GGA calculations. The nu(Ru-O) stretch mode is found at 67 meV [c(2 times 4)-2O] and 64 meV [(2 times 1)pg-2O].

cond-mat

The Adsorption of Atomic Nitrogen on Ru(0001): Geometry and Energetics

The local adsorption geometries of the (2x2)-N and the (sqrt(3)x sqrt(3))R30^o -N phases on the Ru(0001) surface are determined by analyzing low-energy electron diffraction (LEED) intensity data. For both phases, nitrogen occupies the threefold hcp site. The nitrogen sinks deeply into the top Ru layer resulting in a N-Ru interlayer distance of 1.05 AA and 1.10 AA in the (2x2) and the (sqrt(3)x sqrt(3))R30^o unit cell, respectively. This result is attributed to a strong N binding to the Ru surface (Ru--N bond length = 1.93 AA) in both phases as also evidenced by ab-initio calculations which revealed binding energies of 5.82 eV and 5.59 eV, respectively.

cond-mat.mtrl-sci