Thermodynamic and dynamic anomalies for a three dimensional isotropic core-softened potential

Using molecular dynamics simulations and integral equations (Rogers-Young, Percus-Yevick and hypernetted chain closures) we investigate the thermodynamic of particles interacting with continuous core-softened intermolecular potential. Dynamic properties are also analyzed by the simulations. We show that, for a chosen shape of the potential, the density, at constant pressure, has a maximum for a certain temperature. The line of temperatures of maximum density (TMD) was determined in the pressure-temperature phase diagram. Similarly the diffusion constant at a constant temperature, $D$, has a maximum at a density $\rho_{max}$ and a minimum at a density $\rho_{min}<\rho_{max}$. In the pressure-temperature phase-diagram the line of extrema in diffusivity is outside of TMD line. Although in this interparticle potential lacks directionality, this is the same behavior observed in SPC/E water.Comment: 16 page

Rugged landscapes: Complexity and implementation science

BACKGROUND: Mis-implementation-defined as failure to successfully implement and continue evidence-based programs-is widespread in public health practice. Yet the causes of this phenomenon are poorly understood. METHODS: We develop an agent-based computational model to explore how complexity hinders effective implementation. The model is adapted from the evolutionary biology literature and incorporates three distinct complexities faced in public health practice: dimensionality, ruggedness, and context-specificity. Agents in the model attempt to solve problems using one of three approaches-Plan-Do-Study-Act (PDSA), evidence-based interventions (EBIs), and evidence-based decision-making (EBDM). RESULTS: The model demonstrates that the most effective approach to implementation and quality improvement depends on the underlying nature of the problem. Rugged problems are best approached with a combination of PDSA and EBI. Context-specific problems are best approached with EBDM. CONCLUSIONS: The model\u27s results emphasize the importance of adapting one\u27s approach to the characteristics of the problem at hand. Evidence-based decision-making (EBDM), which combines evidence from multiple independent sources with on-the-ground local knowledge, is a particularly potent strategy for implementation and quality improvement

Implementation of the Hierarchical Reference Theory for simple one-component fluids

Combining renormalization group theoretical ideas with the integral equation approach to fluid structure and thermodynamics, the Hierarchical Reference Theory is known to be successful even in the vicinity of the critical point and for sub-critical temperatures. We here present a software package independent of earlier programs for the application of this theory to simple fluids composed of particles interacting via spherically symmetrical pair potentials, restricting ourselves to hard sphere reference systems. Using the hard-core Yukawa potential with z=1.8/sigma for illustration, we discuss our implementation and the results it yields, paying special attention to the core condition and emphasizing the decoupling assumption's role.Comment: RevTeX, 16 pages, 2 figures. Minor changes, published versio

The Evolving Treatment Landscape of Advanced Renal Cell Carcinoma in Patients Progressing after VEGF Inhibition

Despite significant changes in the therapeutic landscape of renal cell carcinoma, the majority of patients with metastatic disease eventually progress after first-line treatment with vascular endothelial growth factor receptors (VEGFR) tyrosine kinase inhibitor (TKI) therapy. Understanding existing data on subsequent therapies is crucial to define an optimal treatment sequence following first-line failure. This review examines the data supporting currently approved agents in this setting and provides a framework for decision-making regarding treatment sequencing beyond first-line therapy with VEGFR TKIs

Sharp error terms for return time statistics under mixing conditions

We describe the statistics of repetition times of a string of symbols in a stochastic process. Denote by T(A) the time elapsed until the process spells the finite string A and by S(A) the number of consecutive repetitions of A. We prove that, if the length of the string grows unbondedly, (1) the distribution of T(A), when the process starts with A, is well aproximated by a certain mixture of the point measure at the origin and an exponential law, and (2) S(A) is approximately geometrically distributed. We provide sharp error terms for each of these approximations. The errors we obtain are point-wise and allow to get also approximations for all the moments of T(A) and S(A). To obtain (1) we assume that the process is phi-mixing while to obtain (2) we assume the convergence of certain contidional probabilities

Shuffling cards, factoring numbers, and the quantum baker's map

It is pointed out that an exactly solvable permutation operator, viewed as the quantization of cyclic shifts, is useful in constructing a basis in which to study the quantum baker's map, a paradigm system of quantum chaos. In the basis of this operator the eigenfunctions of the quantum baker's map are compressed by factors of around five or more. We show explicitly its connection to an operator that is closely related to the usual quantum baker's map. This permutation operator has interesting connections to the art of shuffling cards as well as to the quantum factoring algorithm of Shor via the quantum order finding one. Hence we point out that this well-known quantum algorithm makes crucial use of a quantum chaotic operator, or at least one that is close to the quantization of the left-shift, a closeness that we also explore quantitatively.Comment: 12 pgs. Substantially elaborated version, including a new route to the quantum bakers map. To appear in J. Phys.

Chaos for Liouville probability densities

Using the method of symbolic dynamics, we show that a large class of classical chaotic maps exhibit exponential hypersensitivity to perturbation, i.e., a rapid increase with time of the information needed to describe the perturbed time evolution of the Liouville density, the information attaining values that are exponentially larger than the entropy increase that results from averaging over the perturbation. The exponential rate of growth of the ratio of information to entropy is given by the Kolmogorov-Sinai entropy of the map. These findings generalize and extend results obtained for the baker's map [R. Schack and C. M. Caves, Phys. Rev. Lett. 69, 3413 (1992)].Comment: 26 pages in REVTEX, no figures, submitted to Phys. Rev.

Can music move people? : The effects of musical complexity and silence on waiting time

Previous research has suggested that music might influence the amount of time for which people are prepared to wait in a given environment. In an attempt to investigate the mechanisms underlying such effects, this study employed three levels of musical complexity and also a “no-music” condition. While one of these played in the background, participants were left to wait in a laboratory for the supposed start of an experiment. The results indicated that participants waited for the least amount of time during the no-music condition, and that there were no differences between the three music conditions. Other evidence indicated that this may be attributable to the music distracting participants’ attention from an internal timing mechanism. The results are discussed in terms of their implications for consumer behavior and research on the psychology of everyday life

Foundations for Relativistic Quantum Theory I: Feynman's Operator Calculus and the Dyson Conjectures

In this paper, we provide a representation theory for the Feynman operator calculus. This allows us to solve the general initial-value problem and construct the Dyson series. We show that the series is asymptotic, thus proving Dyson's second conjecture for QED. In addition, we show that the expansion may be considered exact to any finite order by producing the remainder term. This implies that every nonperturbative solution has a perturbative expansion. Using a physical analysis of information from experiment versus that implied by our models, we reformulate our theory as a sum over paths. This allows us to relate our theory to Feynman's path integral, and to prove Dyson's first conjecture that the divergences are in part due to a violation of Heisenberg's uncertainly relations

Weak point disorder in strongly fluctuating flux-line liquids

We consider the effect of weak uncorrelated quenched disorder (point defects) on a strongly fluctuating flux-line liquid. We use a hydrodynamic model which is based on mapping the flux-line system onto a quantum liquid of relativistic charged bosons in 2+1 dimensions [P. Benetatos and M. C. Marchetti, Phys. Rev. B 64, 054518, (2001)]. In this model, flux lines are allowed to be arbitrarily curved and can even form closed loops. Point defects can be scalar or polar. In the latter case, the direction of their dipole moments can be random or correlated. Within the Gaussian approximation of our hydrodynamic model, we calculate disorder-induced corrections to the correlation functions of the flux-line fields and the elastic moduli of the flux-line liquid. We find that scalar disorder enhances loop nucleation, and polar (magnetic) defects decrease the tilt modulus.Comment: 15 pages, submitted to Pramana-Journal of Physics for the special volume on Vortex State Studie