Structural and electronic properties of graphite layers grown on SiC(0 0 0 1)

Photoelectron spectroscopy, low-energy electron diffraction, and scanning probe microscopy were used to investigate the electronic and structural properties of graphite layers grown by solid state graphitization of SiC(0 0 0 1) surfaces. The process leads to well-ordered graphite layers which are rotated against the substrate lattice by 30°. On on-axis 6H-SiC(0 0 0 1) substrates we observe graphitic layers with up to several 100 nm wide terraces. ARUPS spectra of the graphite layers grown on on-axis 6H-SiC(0 0 0 1) surfaces are indicative of a well-developed band structure. For the graphite/n-type 6H-SiC(0 0 0 1) layer system we observe a Schottky barrier height of ?_B,n = 0.3 ± 0.1 eV. ARUPS spectra of graphite layers grown on 8° off-axis oriented 4H-SiC(0 0 0 1) show unique replicas which are explained by a carpet-like growth mode combined with a step bunching of the substrate.     

Papieruntersuchung

Analytical and Bioanalytical Chemistry -     

Globally Linked Pairs of Vertices in Equivalent Realizations of Graphs

A two-dimensional framework (G,p) is a graph G = (V,E) together with a map p: V → ℝ². We view (G,p) as a straight line realization of G in ℝ². Two realizations of G are equivalent if the corresponding edges in the two frameworks have the same length. A pair of vertices {u,v} is globally linked in G if %and for all equivalent frameworks (G,q), the distance between the points corresponding to u and v is the same in all pairs of equivalent generic realizations of G. The graph G is globally rigid if all of its pairs of vertices are globally linked. We extend the characterization of globally rigid graphs given by the first two authors [13] by characterizing globally linked pairs in M-connected graphs, an important family of rigid graphs. As a byproduct we simplify the proof of a result of Connelly [6] which is a key step in the characterization of globally rigid graphs. We also determine the number of distinct realizations of an M-connected graph, each of which is equivalent to a given generic realization. Bounds on this number for minimally rigid graphs were obtained by Borcea and Streinu in [3].     

Discovery and frequency measurement of short-wavelength far-infrared laser emissions from optically pumped <Superscript>13</Superscript>CD<Subscript>3</Subscript>OH and CHD<Subscript>2</Subscript>OH

A three-laser heterodyne system was used to measure the frequencies of twelve previously observed far-infrared laser emissions from the partially deuterated methanol isotopologues ¹³CD₃OH and CHD₂OH. Two laser emissions, a 53.773 μm line from ¹³CD₃OH and a 74.939 μm line from CHD₂OH, have also been discovered and frequency measured. The CO₂ pump laser offset frequency was measured with respect to its center frequency for twenty-four FIR laser emissions from CH₃OH, ¹³CD₃OH and CHD₂OH. PACS 07.57.Hm; 42.55.Lt; 42.62.Eh     

Highly edge‐connected detachments of graphs and digraphs

Let G = (V,E) be a graph or digraph and r : V → Z₊. An r‐detachment of G is a graph H obtained by ‘splitting’ each vertex ν ∈ V into r(ν) vertices. The vertices ν₁,…,ν_r(ν) obtained by splitting ν are called the pieces of ν in H. Every edge uν ∈ E corresponds to an edge of H connecting some piece of u to some piece of ν. Crispin Nash‐Williams 9 gave necessary and sufficient conditions for a graph to have a k‐edge‐connected r‐detachment. He also solved the version where the degrees of all the pieces are specified. In this paper, we solve the same problems for directed graphs. We also give a simple and self‐contained new proof for the undirected result. © 2003 Wiley Periodicals, Inc. J Graph Theory 43: 67–77, 2003     

COSMIC(90): An improved molecular mechanics treatment of hydrocarbons and conjugated systems

Summary Four modifications to the COSMIC molecular mechanics force field are described, which greatly increase both its versatility and the accuracy of calculated conformational energies. The Hill non-bonded van der Waals potential function has been replaced by a two-parameter Morse curve and a new H-H potential, similar to that in MM3, incorporated. Hydrocarbon energies in particular are much improved.A simple iterative Hückel pi-electron molecular orbital calculation allows modelling of conjugated systems. Calculated bond lengths and rotational barriers for a series of conjugated hydrocarbons and nitrogen heterocycles are shown to be as accurate as those determined by the MM2 SCF method.Explicit hydrogen-bonding potentials for H-bond acceptor-donor atom pairs have been included to give better hydrogen bond energies and lengths. The van der Waals radii of protonic hydrogens are reduced to 0.5 Å and the energy well depth is increased to 1.0 kcal mol^-1.Two new general atom types, N⁺ _sp ² and O^- _sp ³ , have been introduced which allow a wide variety of charged conjugated systems to be studied. A minimum of parameterisation is required, as the new types are easily included in the Hückel scheme which automatically adjusts bond and torsional parameters according to the defined bond-order relationships.     

Algebras with Collapsing Monomials

A semigroup S is called collapsing if there exists a positiveinteger n such that for every subset of n elements in S, atleast two distinct words of length n on these letters are equalin S. In particular, S is collapsing whenever it satisfies alaw. Let U(A) denote the group of units of a unitary associativealgebra A over a field k of characteristic zero. If A is generatedby its nilpotent elements, then the following conditions areequivalent: U(A) is collapsing; U(A) satisfies some semigrouplaw; U(A) satisfies the Engel condition; U(A) is nilpotent;A is nilpotent when considered as a Lie algebra.