Progress using generalized lattice Dirac operators to parametrize the Fixed-Point QCD action

We report on an ongoing project to parametrize the Fixed-Point Dirac operator for massless quarks, using a very general construction which has arbitrarily many fermion offsets and gauge paths, the complete Clifford algebra and satisfies all required symmetries. Optimizing a specific construction with hypercubic fermion offsets, we present some preliminary results.Comment: Lattice 2000 (Improvement), 9 pages, based on a talk by K.H. and a poster by T.J. References adde

The construction of generalized Dirac operators on the lattice

We discuss the steps to construct Dirac operators which have arbitrary fermion offsets, gauge paths, a general structure in Dirac space and satisfy the basic symmetries (gauge symmetry, hermiticity condition, charge conjugation, hypercubic rotations and reflections) on the lattice. We give an extensive set of examples and offer help to add further structures.Comment: 19 pages, latex, maple code attache

Alkoxyallene‐Based LANCA Three‐Component Synthesis of 1,2‐Diketones, Quinoxalines, and Unique Isoindenone Dimers and a Computational Study of the Isoindenone Dimerization

A series of β‐alkoxy‐β‐ketoenamides was prepared by the well‐established LANCA three‐component reaction of lithiated 1‐(2‐trimethylsilylethoxy)‐substituted allenes, nitriles, and α,β‐unsaturated carboxylic acids. The α‐tert‐butyl‐substituted compounds were smoothly converted into the expected 1,2‐diketones by treatment with trifluoroacetic acid. A subsequent condensation of the 1,2‐diketones with o‐phenylenediamine provided the desired highly substituted quinoxalines in good overall yield. Surprisingly, the α‐phenyl‐substituted β‐alkoxy‐β‐ketoenamides investigated afford not only the expected 1,2‐diketones, but also pentacyclic compounds with an anti‐tricyclo[4.2.1.12,5]deca‐3,7‐diene‐9,10‐dione core. These interesting products are very likely the result of an isoindenone dimerization which was mechanistically studied with the support of DFT calculations. Under the strongly acidic reaction conditions, a stepwise reaction is likely leading to a protonated isoindenone as reactive intermediate. It may first form a van der Waals complex with a neutral isoindenone before the two regio‐ and diastereoselective ring forming steps occur. Interestingly, two neutral or two protonated isoindenones are also predicted to dimerize giving the observed pentacyclic product

Another weak first order deconfinement transition: three-dimensional SU(5) gauge theory

We examine the finite-temperature deconfinement phase transition of (2+1)-dimensional SU(5) Yang-Mills theory via non-perturbative lattice simulations. Unsurprisingly, we find that the transition is of first order, however it appears to be weak. This fits naturally into the general picture of "large" gauge groups having a first order deconfinement transition, even when the center symmetry associated with the transition might suggest otherwise.Comment: 17 pages, 8 figure

Adaptive intelligence applied to numerical optimisation

The article presents modification strategies theoretical comparison and experimental results achieved by adaptive heuristics applied to numerical optimisation of several non-constraint test functions. The aims of the study are to identify and compare how adaptive search heuristics behave within heterogeneous search space without retuning of the search parameters. The achieved results are summarised and analysed, which could be used for comparison to other methods and further investigation

Absence of evidence for pentaquarks on the lattice

We study the question of whether or not QCD predicts a pentaquark state. We use the improved, fixed point lattice QCD action which has very little sensitivity to the lattice spacing and also allows us to reach light quark masses. The analysis was performed on a single volume of size $(1.8 {\rm fm})^3\times 3.6 {\rm fm}$ with lattice spacing of $a=0.102$ fm. We use the correlation matrix method to identify the ground and excited states in the isospin 0, negative parity channel. In the quenched approximation where dynamical quark effects are omitted, we do not find any evidence for a pentaquark resonance in QCD.Comment: 17 pages, 5 figures replaced with revised versio

Electronic structure theory of the hidden order material URu2_2Si2_2

We report a comprehensive electronic structure investigation of the paramagnetic (PM), the large moment antiferromagnetic (LMAF), and the hidden order (HO) phases of URu$_2$Si$_2$. We have performed relativistic full-potential calculations on the basis of the density functional theory (DFT), employing different exchange-correlation functionals to treat electron correlations within the open $5f$-shell of uranium. Specifically, we investigate---through a comparison between calculated and low-temperature experimental properties---whether the $5f$ electrons are localized or delocalized in URu$_2$Si$_2$. We also performed dynamical mean field theory calculations (LDA+DMFT) to investigate the temperature evolution of the quasi-particle states at 100~K and above, unveiling a progressive opening of a quasi-particle gap at the chemical potential when temperature is reduced. A detailed comparison of calculated properties with known experimental data demonstrates that the LSDA and GGA approaches, in which the uranium $5f$ electrons are treated as itinerant, provide an excellent explanation of the available low-temperature experimental data of the PM and LMAF phases. We show furthermore that due to a materials-specific Fermi surface instability a large, but partial, Fermi surface gapping of up to 750 K occurs upon antiferromagnetic symmetry breaking. The occurrence of the HO phase is explained through dynamical symmetry breaking induced by a mode of long-lived antiferromagnetic spin-fluctuations. This dynamical symmetry breaking model explains why the Fermi surface gapping in the HO phase is similar but smaller than that in the LMAF phase and it also explains why the HO and LMAF phases have the same Fermi surfaces yet different order parameters. Suitable derived order parameters for the HO are proposed to be the Fermi surface gap or the dynamic spin-spin correlation function.Comment: 23 pages, 20 figure

Relativistic quantum mechanics and the Bohmian interpretation

Conventional relativistic quantum mechanics, based on the Klein-Gordon equation, does not possess a natural probabilistic interpretation in configuration space. The Bohmian interpretation, in which probabilities play a secondary role, provides a viable interpretation of relativistic quantum mechanics. We formulate the Bohmian interpretation of many-particle wave functions in a Lorentz-covariant way. In contrast with the nonrelativistic case, the relativistic Bohmian interpretation may lead to measurable predictions on particle positions even when the conventional interpretation does not lead to such predictions.Comment: 10 pages, revised, to appear in Found. Phys. Let

A New Metaheuristic Bat-Inspired Algorithm

Metaheuristic algorithms such as particle swarm optimization, firefly algorithm and harmony search are now becoming powerful methods for solving many tough optimization problems. In this paper, we propose a new metaheuristic method, the Bat Algorithm, based on the echolocation behaviour of bats. We also intend to combine the advantages of existing algorithms into the new bat algorithm. After a detailed formulation and explanation of its implementation, we will then compare the proposed algorithm with other existing algorithms, including genetic algorithms and particle swarm optimization. Simulations show that the proposed algorithm seems much superior to other algorithms, and further studies are also discussed.Comment: 10 pages, 2 figure