A joint theoretical and kinetic investigation on the fragmentation of (N-halo)-2-amino cycloalkanecarboxylates

A combined theoretical and experimental study to elucidate the molecular mechanism for the Grob fragmentation of different (N-halo)-2-amino cyclocarboxylates with the nitrogen atom in exocyclic position: (N-Cl)-2-amino cyclopropanecarboxylate (1), (N-Cl)-2-amino cyclobutanecarboxylate (2), (N-Cl)-2-amino cyclopentanecarboxylate (3) and (N-Cl)-2-amino cyclohexanecarboxylate (4), and the corresponding acyclic compounds, (N-Cl)-2-amino isobutyric acid (A), (N-Cl)-2-amino butyric acid (B), has been carried out. The kinetics of decomposition for these compounds and related bromine derivatives were experimentally determined by conventional and stopped-flow UV spectrophotometry. The reaction products have been analyzed by GC and spectrophotometry. Theoretical analysis is based in the localization of stationary points (reactants and transition structures) on the potential energy surface. Calculations were carried out at B3LYP/6-31+G* and MP2/6-31+G* computing methods in the gas phase, while solvent effects have been included by means the self-consistent reaction field theory, PCM continuum model, at MP2/6-31+G* and MP4/6-31+G*//MP2/6-31+G* calculation levels. Based on both experimental and theoretical results, the different Grob fragmentation processes show a global synchronicity index close to 0.9, corresponding to a nearly concerted process. At the TSs, the N-Cl bond breaking is more advanced than the C-C cleavage process. An antiperiplanar configuration of these bonds is reached at the TSs, and this geometrical arrangement is the key factor governing the decomposition. In the case of 1 and 2 the ring strain prevents this spatial disposition, leading to a larger value of the activation barrier. Natural population analysis shows that the polarization of the N-Cl and C-C bonds along the bond-breaking process can be considered the driving force for the decomposition and that a negative charge flows from the carboxylate group to the chlorine atom to assist the reaction pathway. A comparison of theoretical and experimental results shows the relevance of calculation level and the inclusion of solvent effects for determining accurate unimolecular rate coefficients for the decomposition process. © 2002 Published by Elsevier Science B.V.

On the role of boundary terms in the AdS/CFT correspondence

We consider a scalar field theory on AdS, and show that the usual AdS/CFT prescription is unable to map to the boundary a part of the information arising from the quantization in the bulk. We propose a solution to this problem by defining the energy of the theory in the bulk through the Noether current corresponding to time displacements, and, in addition, by introducing a proper generalized AdS/CFT prescription. We also show how this extended formulation could be used to consistently describe double-trace interactions in the boundary. The formalism is illustrated by focusing on the non-minimally coupled case using Dirichlet boundary conditions. © 2004 Published by Elsevier B.V.

Euclidean 4d exact solitons in a Skyrme type model

We introduce a Skyrme type, four-dimensional Euclidean field theory made of a triplet of scalar fields n→, taking values on the sphere S2, and an additional real scalar field φ, which is dynamical only on a three-dimensional surface embedded in R4. Using a special ansatz we reduce the 4d non-linear equations of motion into linear ordinary differential equations, which lead to the construction of an infinite number of exact soliton solutions with vanishing Euclidean action. The theory possesses a mass scale which fixes the size of the solitons in way which differs from Derrick's scaling arguments. The model may be relevant to the study of the low energy limit of pure SU(2) Yang-Mills theory. © 2004 Elsevier B.V. All rights reserved.

Pure spinor formalism as an N ≤ 2 topological string

Following suggestions of Nekrasov and Siegel, a non-minimal set of fields are added to the pure spinor formalism for the superstring. Twisted ĉ ≤ 3 N ≤ 2 generators are then constructed where the pure spinor BRST operator is the fermionic spin-one generator, and the formalism is interpreted as a critical topological string. Three applications of this topological string theory include the super-Poincaré covariant computation of multiloop superstring amplitudes without picture-changing operators, the construction of a cubic open superstring field theory without contact-term problems, and a new four-dimensional version of the pure spinor formalism which computes F-terms in the spacetime action. © SISSA 2005.

Improved Langevin approach to spinodal decomposition in the chiral transition

We use an improved Langevin description that incorporates both additive and multiplicative noise terms to study the dynamics of phase ordering. We perform real-time lattice simulations to investigate the role played by different contributions to the dissipation and noise. Lattice-size independence is assured by the use of appropriate lattice counterterms. © 2006 American Institute of Physics.

Pseudospin and spin symmetries in the relativistic harmonic oscillator

We compute the analytical solutions of the generalized relativistic harmonic oscillator in 1+1 dimensions, including a linear pseudoscalar potential and quadratic scalar and vector potentials which have equal or opposite signs These are the conditions in which pseudospin or spin symmetries can be realized We consider positive and negative quadratic potentials and present their bound-state solutions for fermions and an-tifermions. We relate the spin-type and pseudospin-type spectra through charge conjugation and γ5 chiral transformations. Finally, we establish a relation of the solutions found with single-particle states of nuclei described by relativistic mean-field theories with tensor interactions and discuss the conditions in which one may have both nucleon and antin-ucleon bound states.

One-dimensional superfluid Bose-Fermi mixture: Mixing, demixing, and bright solitons

We study an ultracold and dilute superfluid Bose-Fermi mixture confined in a strictly one-dimensional (1D) atomic waveguide by using a set of coupled nonlinear mean-field equations obtained from the Lieb-Liniger energy density for bosons and the Gaudin-Yang energy density for fermions. We consider a finite Bose-Fermi interatomic strength gbf and both periodic and open boundary conditions. We find that with periodic boundary conditions-i.e., in a quasi-1D ring-a uniform Bose-Fermi mixture is stable only with a large fermionic density. We predict that at small fermionic densities the ground state of the system displays demixing if gbf >0 and may become a localized Bose-Fermi bright soliton for gbf <0. Finally, we show, using variational and numerical solutions of the mean-field equations, that with open boundary conditions-i.e., in a quasi-1D cylinder-the Bose-Fermi bright soliton is the unique ground state of the system with a finite number of particles, which could exhibit a partial mixing-demixing transition. In this case the bright solitons are demonstrated to be dynamically stable. The experimental realization of these Bose-Fermi bright solitons seems possible with present setups. © 2007 The American Physical Society.

Nonpertubative solutions of massless gauged thirring model

We present a nonperturbative quantization of the two-dimensional massless gauged Thirring model by using the path-integral approach. First, we will study the constraint structure of model via the Dirac's formalism and by using the Faddeev-Senjanovic method we calculate the vacuum-vacuum transition amplitude in a Rξ-gauge, then we compute the Green's functions in a nonperturbative framework. © 2010 American Institute of Physics.

Bifundamental fuzzy 2-Sphere and fuzzy killing spinors

We review our construction of a bifundamental version of the fuzzy 2-sphere and its relation to fuzzy Killing spinors, first obtained in the context of the ABJM membrane model. This is shown to be completely equivalent to the usual (adjoint) fuzzy sphere. We discuss the mathematical details of the bifundamental fuzzy sphere and its field theory expansion in a model-independent way. We also examine how this new formulation affects the twisting of the fields, when comparing the field theory on the fuzzy sphere background with the compactification of the 'deconstructed' (higher dimensional) field theory.

Nilpotent orbits and codimension-2 defects of 6d N = (2, 0)theories

We study the local properties of a class of codimension-2 defects of the 6d N = (2, 0) theories of type J = A, D, E labeled by nilpotent orbits of a Lie algebra $g, where g is determined by J and the outer-automorphism twist around the defect. This class is a natural generalization of the defects of the six-dimensional (6d) theory of type SU(N) labeled by a Young diagram with N boxes. For any of these defects, we determine its contribution to the dimension of the Higgs branch, to the Coulomb branch operators and their scaling dimensions, to the four-dimensional (4d) central charges a and c and to the flavor central charge k. © 2013 World Scientific Publishing Company.

Dynamical twisting and the b ghost in the pure spinor formalism

After adding an RNS-like fermionic vector ψ m to the pure spinor formalism, the non-minimal b ghost takes a simple form similar to the pure spinor BRST operator. The N=2 superconformal field theory generated by the b ghost and the BRST current can be interpreted as a dynamical twisting of the RNS formalism where the choice of which spin 1/2 ψ m variables are twisted into spin 0 and spin 1 variables is determined by the pure spinor variables that parameterize the coset SO(10)/U(5). © 2013 SISSA, Trieste, Italy.

O modelo padrão das interações eletrofracas: aspectos fenomenológicos do setor escalar e sua extensão supersimétrica

Pós-graduação em Física - FEG

Can entanglement explain black hole entropy?

Conselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)

Partículas de spin-1 em D-dimensões via tensor simétrico

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)

Modelos não lineares com campos escalares: ladrilhamento e mundos-brana

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)