Normalizers of Operator Algebras and Reflexivity

The set of normalizers between von Neumann (or, more generally, reflexive) algebras A and B, (that is, the set of all operators x such that xAx* is a subset of B and x*Bx is a subset of A) possesses `local linear structure': it is a union of reflexive linear spaces. These spaces belong to the interesting class of normalizing linear spaces, namely, those linear spaces U for which UU*U is a subset of U. Such a space is reflexive whenever it is ultraweakly closed, and then it is of the form U={x:xp=h(p)x, for all p in P}, where P is a set of projections and h a certain map defined on P. A normalizing space consists of normalizers between appropriate von Neumann algebras A and B. Necessary and sufficient conditions are found for a normalizing space to consist of normalizers between two reflexive algebras. Normalizing spaces which are bimodules over maximal abelian selfadjoint algebras consist of operators `supported' on sets of the form [f=g] where f and g are appropriate Borel functions. They also satisfy spectral synthesis in the sense of Arveson.Comment: 20 pages; to appear in the Proceedings of the London Mathematical Societ

Are current-induced forces conservative?

The expression for the force on an ion in the presence of current can be derived from first principles without any assumption about its conservative character. However, energy functionals have been constructed that indicate that this force can be written as the derivative of a potential function. On the other hand, there exist compelling specific arguments that strongly suggest the contrary. We propose physical mechanisms that invalidate such arguments and demonstrate their existence with first-principles calculations. While our results do not constitute a formal resolution to the fundamental question of whether current-induced forces are conservative, they represent a substantial step forward in this direction.Comment: 4 pages, 4 Figures, submitted to PR

Power dissipation in nanoscale conductors: classical, semi-classical and quantum dynamics

Modelling Joule heating is a difficult problem because of the need to introduce correct correlations between the motions of the ions and the electrons. In this paper we analyse three different models of current induced heating (a purely classical model, a fully quantum model and a hybrid model in which the electrons are treated quantum mechanically and the atoms are treated classically). We find that all three models allow for both heating and cooling processes in the presence of a current, and furthermore the purely classical and purely quantum models show remarkable agreement in the limit of high biases. However, the hybrid model in the Ehrenfest approximation tends to suppress heating. Analysis of the equations of motion reveals that this is a consequence of two things: the electrons are being treated as a continuous fluid and the atoms cannot undergo quantum fluctuations. A means for correcting this is suggested

Getting to know you: Accuracy and error in judgments of character

Character judgments play an important role in our everyday lives. However, decades of empirical research on trait attribution suggest that the cognitive processes that generate these judgments are prone to a number of biases and cognitive distortions. This gives rise to a skeptical worry about the epistemic foundations of everyday characterological beliefs that has deeply disturbing and alienating consequences. In this paper, I argue that this skeptical worry is misplaced: under the appropriate informational conditions, our everyday character-trait judgments are in fact quite trustworthy. I then propose a mindreading-based model of the socio-cognitive processes underlying trait attribution that explains both why these judgments are initially unreliable, and how they eventually become more accurate

Automatic Generation of Matrix Element Derivatives for Tight Binding Models

Tight binding (TB) models are one approach to the quantum mechanical many particle problem. An important role in TB models is played by hopping and overlap matrix elements between the orbitals on two atoms, which of course depend on the relative positions of the atoms involved. This dependence can be expressed with the help of Slater-Koster parameters, which are usually taken from tables. Recently, a way to generate these tables automatically was published. If TB approaches are applied to simulations of the dynamics of a system, also derivatives of matrix elements can appear. In this work we give general expressions for first and second derivatives of such matrix elements. Implemented in a computer program they obviate the need to type all the required derivatives of all occuring matrix elements by hand.Comment: 11 pages, 2 figure

A Unified Conformal Field Theory Description of Paired Quantum Hall States

The wave functions of the Haldane-Rezayi paired Hall state have been previously described by a non-unitary conformal field theory with central charge c=-2. Moreover, a relation with the c=1 unitary Weyl fermion has been suggested. We construct the complete unitary theory and show that it consistently describes the edge excitations of the Haldane-Rezayi state. Actually, we show that the unitary (c=1) and non-unitary (c=-2) theories are related by a local map between the two sets of fields and by a suitable change of conjugation. The unitary theory of the Haldane-Rezayi state is found to be the same as that of the 331 paired Hall state. Furthermore, the analysis of modular invariant partition functions shows that no alternative unitary descriptions are possible for the Haldane-Rezayi state within the class of rational conformal field theories with abelian current algebra. Finally, the known c=3/2 conformal theory of the Pfaffian state is also obtained from the 331 theory by a reduction of degrees of freedom which can be physically realized in the double-layer Hall systems.Comment: Latex, 42 pages, 2 figures, 3 tables; minor corrections to text and reference

Efficient simulations with electronic open boundaries

We present a reformulation of the Hairy Probe method for introducing electronic open boundaries that is appropriate for steady state calculations involving non-orthogonal atomic basis sets. As a check on the correctness of the method we investigate a perfect atomic wire of Cu atoms, and a perfect non-orthogonal chain of H atoms. For both atom chains we find that the conductance has a value of exactly one quantum unit, and that this is rather insensitive to the strength of coupling of the probes to the system, provided values of the coupling are of the same order as the mean inter-level spacing of the system without probes. For the Cu atom chain we find in addition that away from the regions with probes attached, the potential in the wire is uniform, while within them it follows a predicted exponential variation with position. We then apply the method to an initial investigation of the suitability of graphene as a contact material for molecular electronics. We perform calculations on a carbon nanoribbon to determine the correct coupling strength of the probes to the graphene, and obtain a conductance of about two quantum units corresponding to two bands crossing the Fermi surface. We then compute the current through a benzene molecule attached to two graphene contacts and find only a very weak current because of the disruption of the π-conjugation by the covalent bond between the benzene and the graphene. In all cases we find that very strong or weak probe couplings suppress the current