Effect of atomic scale plasticity on hydrogen diffusion in iron: Quantum mechanically informed and on-the-fly kinetic Monte Carlo simulations

We present an off-lattice, on-the-fly kinetic Monte Carlo (KMC) model for simulating stress-assisted diffusion and trapping of hydrogen by crystalline defects in iron. Given an embedded atom (EAM) potential as input, energy barriers for diffusion are ascertained on the fly from the local environments of H atoms. To reduce computational cost, on-the-fly calculations are supplemented with precomputed strain-dependent energy barriers in defect-free parts of the crystal. These precomputed barriers, obtained with high-accuracy density functional theory calculations, are used to ascertain the veracity of the EAM barriers and correct them when necessary. Examples of bulk diffusion in crystals containing a screw dipole and vacancies are presented. Effective diffusivities obtained from KMC simulations are found to be in good agreement with theory. Our model provides an avenue for simulating the interaction of hydrogen with cracks, dislocations, grain boundaries, and other lattice defects, over extended time scales, albeit at atomistic length scales

Sense of Self in Baby Chimpanzees

Philippe Rochat and his colleague tentatively proposed that young infants' propensity to engage in self-perception and systematic exploration of the perceptual consequences of their own action plays and is probably at the origin of an early sense of self: the ecological self. Rochat and Hespos (1997) reported that neonates discriminate between external and self-stimulation. Neonate tended to display significantly more rooting responses (i.e., head turn towards the stimulation with mouth open and tonguing) following external compared to self-stimulation. Rochat et al. (1998) also reported that 2-month-olds showed clear sign of modulation of their oral activity on the pacifier as a function of analog versus non-analog condition. Rochat and his colleague concluded that these observations are interpreted as evidence of self-exploration and the emergence of a sense of self-agency by 2-month-olds. We tried to replicate these findings in infant chimpanzees. We observed rooting responses of three baby chimpanzees in two condition, self-stimulation and external stimulation. In external stimulation condition, the index finger of the experimenter or small stick touched one of the infant's cheeks. In self-stimulation condition, the experimenter took infant's hand and touched his or her cheek with their fingers. In Rochat and Hespos, they recorded and analyzed several measures such as state, head movement, mouth activity and so on. How ever, we analyzed only mouth activities tentatively. We found infant chimpanzees tended to show more rooting responses following external stimulation compared to self-stimulation as well as human infants. We also carried out sucking experiment with two baby chimpanzees. The experimenter held the pacifier and put the artificial nipple into the infant's mouth. A session started when the infant take the nipple inside the his or her mouth. Auditory stimulus, which was a complex tone comprised of six harmonics with equal intensity, was given to the chimpanzee according to the test condition during their sucking. There were four test conditions and each condition consisted with three types of feedback as follows: 1) silent baseline, contingent, and steady, 2) contingent baseline, 1-sec delay, and 3-sec delay, 3) contingent baseline, 6-sec delay, and 12-sec delay, 4) contingent baseline, 1/2 efficiency, and 1/4 efficiency. In test 1, one infant chimpanzee showed decrease of the minimum pressure of sucking in the contingent condition. In test 2, one subject showed shorter intervals of sucking in 3-sec delay condition. This seems to be similar to human infant's. We may be able to postulate ecological self in baby chimpanzees according to the self-exploration. In test 3 and 4, we did not obtain any effects of stimulus conditions. Results of these studies. These studies were conducted as the parts of the chimpanzee development project in Primate Research Institute, Kyoto University, organized by Professor Tetsuro Matsuzawa

Dynamical Chiral Symmetry Breaking on the Light Front.II. The Nambu--Jona-Lasinio Model

An investigation of dynamical chiral symmetry breaking on the light front is made in the Nambu--Jona-Lasinio model with one flavor and N colors. Analysis of the model suffers from extraordinary complexity due to the existence of a "fermionic constraint," i.e., a constraint equation for the bad spinor component. However, to solve this constraint is of special importance. In classical theory, we can exactly solve it and then explicitly check the property of ``light-front chiral transformation.'' In quantum theory, we introduce a bilocal formulation to solve the fermionic constraint by the 1/N expansion. Systematic 1/N expansion of the fermion bilocal operator is realized by the boson expansion method. The leading (bilocal) fermionic constraint becomes a gap equation for a chiral condensate and thus if we choose a nontrivial solution of the gap equation, we are in the broken phase. As a result of the nonzero chiral condensate, we find unusual chiral transformation of fields and nonvanishing of the light-front chiral charge. A leading order eigenvalue equation for a single bosonic state is equivalent to a leading order fermion-antifermion bound-state equation. We analytically solve it for scalar and pseudoscalar mesons and obtain their light-cone wavefunctions and masses. All of the results are entirely consistent with those of our previous analysis on the chiral Yukawa model.Comment: 23 pages, REVTEX, the version to be published in Phys.Rev.D; Some clarifications in discussion of the LC wavefunctions adde

An analytic study towards instabilities of the glasma

Strong longitudinal color flux fields will be created in the initial stage of high-energy nuclear collisions. We investigate analytically time evolution of such boost-invariant color fields from Abelian-like initial conditions, and next examine stability of the boost-invariant configurations against rapidity dependent fluctuations. We find that the magnetic background field has an instability induced by the lowest Landau level whose amplitude grows exponentially. For the electric background field there is no apparent instability although pair creations due to the Schwinger mechanism should be involved.Comment: 4p, 3figs; poster contribution to QM200

p21-activated kinase (PAK) regulates cytoskeletal reorganization and directional migration in human neutrophils

Neutrophils serve as a first line of defense in innate immunity owing in part to their ability to rapidly migrate towards chemotactic factors derived from invading pathogens. As a migratory function, neutrophil chemotaxis is regulated by the Rho family of small GTPases. However, the mechanisms by which Rho GTPases orchestrate cytoskeletal dynamics in migrating neutrophils remain ill-defined. In this study, we characterized the role of p21-activated kinase (PAK) downstream of Rho GTPases in cytoskeletal remodeling and chemotactic processes of human neutrophils. We found that PAK activation occurred upon stimulation of neutrophils with f-Met-Leu-Phe (fMLP), and PAK accumulated at the actin-rich leading edge of stimulated neutrophils, suggesting a role for PAK in Rac-dependent actin remodeling. Treatment with the pharmacological PAK inhibitor, PF3758309, abrogated the integrity of RhoA-mediated actomyosin contractility and surface adhesion. Moreover, inhibition of PAK activity impaired neutrophil morphological polarization and directional migration under a gradient of fMLP, and was associated with dysregulated Ca2+ signaling. These results suggest that PAK serves as an important effector of Rho-family GTPases in neutrophil cytoskeletal reorganization, and plays a key role in driving efficient directional migration of human neutrophils

Monte Carlo renormalization group study of the Heisenberg and XY antiferromagnet on the stacked triangular lattice and the chiral ϕ4\phi^4 model

With the help of the improved Monte Carlo renormalization-group scheme, we numerically investigate the renormalization group flow of the antiferromagnetic Heisenberg and XY spin model on the stacked triangular lattice (STA-model) and its effective Hamiltonian, 2N-component chiral $\phi^4$ model which is used in the field-theoretical studies. We find that the XY-STA model with the lattice size $126\times 144 \times 126$ exhibits clear first-order behavior. We also find that the renormalization-group flow of STA model is well reproduced by the chiral $\phi^4$ model, and that there are no chiral fixed point of renormalization-group flow for N=2 and 3 cases. This result indicates that the Heisenberg-STA model also undergoes first-order transition.Comment: v1:15 pages, 15 figures v2:updated references v3:added comments on the higher order irrelevant scaling variables v4:added results of larger sizes v5:final version to appear in J.Phys.Soc.Jpn Vol.72, No.

Two Langevin equations in the Doi-Peliti formalism

A system-size expansion method is incorporated into the Doi-Peliti formalism for stochastic chemical kinetics. The basic idea of the incorporation is to introduce a new decomposition of unity associated with a so-called Cole-Hopf transformation. This approach elucidates a relationship between two different Langevin equations; one is associated with a coherent-state path-integral expression and the other describes density fluctuations. A simple reaction scheme $X \rightleftarrows X+X$ is investigated as an illustrative example.Comment: 14page

Can children with autism read emotions from the eyes? The eyes test revisited

This study aimed to test two new, simplified tasks related to the eye-test, targeting children with Autism Spectrum Disorder (ASD) and typically developing controls (TD). Test-1 assessed the recognition of emotion/mental states with displays using one word and two eye-pictures, whereas Test-2 presented displays using two words and one eye-picture. Black and white photographs of children were used as materials. A cross-cultural study (Caucasian/East-Asian) with adults was initially carried out to verify generalizability across different ethnic groups. Cross-sectional trajectory analyses were used to compare emotion recognition from the eyes in the two tests. Trajectories were constructed linking performance on both tests either to chronological age or to different measures of mental age (receptive vocabulary based on the BPVS, CARS or ASQ for the ASD group). Performance improved with chronological age in both the ASD and TD groups of children. However, performance in Test-1 was significantly superior in children with ASD, who showed delayed onset and slower rate of improvement than TD children in Test-2. In both the ASD and TD groups the lowest error rate was recorded for the item ‘anger’, suggesting that threat-detection cue mechanisms may be intact in Autism. In general, all children showed good performance on our novel tests, thus making them good candidates for assessing younger children and those with lower general abilities

Dephasing of coupled spin qubit system during gate operations due to background charge fluctuations

It has been proposed that a quantum computer can be constructed based on electron spins in quantum dots or based on a superconducting nanocircuit. During two-qubit operations, the fluctuation of the coupling parameters is a critical factor. One source of such fluctuation is the stirring of the background charges. We focused on the influence of this fluctuation on a coupled spin qubit system. The induced fluctuation in exchange coupling changes the amount of entanglement, fidelity, and purity. In our previous study, the background charge fluctuations were found to be an important channel of dephasing for a single Josephson qubit.Comment: 10 pages, 7 figure. to be publishe