Search results for "FUNCTIONAL"

Vertical spectrum of the C2H 2+ system. An open shell (SC)2-CAS-SDCI study

2003

The open shell (SC)(2)-CAS-SDCI method along with a basis set of atomic natural orbitals (ANO) has been applied for calculating the main ionization potentials of acetylene, as well as the manifold of excited states of the different symmetries up to 32 eV. In this method, the single and double excitations of a CAS space are generated and the corresponding CI matrix is corrected by means of the (SC)(2) procedure that cancels the size-extensivity error and adds some high order contributions. The mean absolute error for the outer-valence X (2)Pi(u)(1pi(u) (-1)), A (2)Sigma(g) (+)(3sigma(g) (-1)), and B (2)Sigma(u) (+)(2sigma(u) (-1)) states, and the inner-valence C (2)Sigma(g) (+)(2sigma(g) (-1…

Modeling ?-lactam interactions in aqueous solution through combined quantum mechanics-molecular mechanics methods

1999

Adiabatic versus non-adiabatic electron transfer at 2D electrode materials

2021

2D electrode materials are often deployed on conductive supports for electrochemistry and there is a great need to understand fundamental electrochemical processes in this electrode configuration. Here, an integrated experimental-theoretical approach is used to resolve the key electronic interactions in outer-sphere electron transfer (OS-ET), a cornerstone elementary electrochemical reaction, at graphene as-grown on a copper electrode. Using scanning electrochemical cell microscopy, and co-located structural microscopy, the classical hexaamineruthenium (III/II) couple shows the ET kinetics trend: monolayer > bilayer > multilayer graphene. This trend is rationalized quantitatively through th…

Modeling and Performance Analysis of Channel Assembling in Multichannel Cognitive Radio Networks With Spectrum Adaptation

2012

[EN] To accommodate spectrum access in multichannel cognitive radio networks (CRNs), the channel-assembling technique, which combines several channels together as one channel, has been proposed in many medium access control (MAC) protocols. However, analytical models for CRNs enabled with this technique have not been thoroughly investigated. In this paper, two representative channel-assembling strategies that consider spectrum adaptation and heterogeneous traffic are proposed, and the performance of these strategies is evaluated based on the proposed continuous-time Markov chain (CTMC) models. Moreover, approximations of these models in the quasistationary regime are analyzed, and closed-fo…

Distinct Patterns of Functional Connectivity During the Comprehension of Natural, Narrative Speech.

2020

Recent continuous task studies, such as narrative speech comprehension, show that fluctuations in brain functional connectivity (FC) are altered and enhanced compared to the resting state. Here, we characterized the fluctuations in FC during comprehension of speech and time-reversed speech conditions. The correlations of Hilbert envelope of source-level EEG data were used to quantify FC between spatially separate brain regions. A symmetric multivariate leakage correction was applied to address the signal leakage issue before calculating FC. The dynamic FC was estimated based on a sliding time window. Then, principal component analysis (PCA) was performed on individually concatenated and te…

Lazy consensus for networks with unknown but bounded disturbances

2007

We consider stationary consensus protocols for networks of dynamic agents. The measure of the neighbors' state is affected by Unknown But Bounded disturbances. Here the main contribution is the formulation and solution of what we call the isin-consensus problem, where the states are required to converge in a tube of ray isin asymptotically or in finite time.

2020

Abstract Efficient neuronal communication between brain regions through oscillatory synchronization at certain frequencies is necessary for cognition. Such synchronized networks are transient and dynamic, established on the timescale of milliseconds in order to support ongoing cognitive operations. However, few studies characterizing dynamic electrophysiological brain networks have simultaneously accounted for temporal non-stationarity, spectral structure, and spatial properties. Here, we propose an analysis framework for characterizing the large-scale phase-coupling network dynamics during task performance using magnetoencephalography (MEG). We exploit the high spatiotemporal resolution of…

Characteristics and Measures for Mobile-Masquerader Detection

2006

Personal mobile devices, as mobile phones, smartphones, and communicators can be easily lost or stolen. Due to the functional abilities of these devices, their use by an unintended person may result in a severe security incident concerning private or corporate data and services. Organizations develop their security policy and mobilize preventive techniques against unauthorized use. Current solutions, however, are still breakable and there still exists strong need for means to detect user substitution when it happens. A crucial issue in designing such means is to define what measures to monitor.

Structural and functional features of human muscle-tendon unit.

2006

This paper reviews the architectural details and the in vivo behavior of the human muscle-tendon unit with the focus on the triceps surae and quadriceps femoris muscles. Recent advances in experimental techniques allow in vivo measurements of muscle-tendon architecture and function. In particular, the use of ultrasonography for measurement of tendon and muscle has expanded our knowledge in the last decade. Furthermore, the nuclear magnetic resonance imaging is opening up new insights not only for three-dimensional anatomical information but also for examining musculo-skeletal motion in vivo. While these two completely non-invasive methods provide kinematic data, in vivo force measurements s…

A Linguistic Model in Component Oriented Programming

2016

Abstract It is a fact that the component-oriented programming, well organized, can bring a large increase in efficiency in the development of large software systems. This paper proposes a model for building software systems by assembling components that can operate independently of each other. The model is based on a computing environment that runs parallel and distributed applications. This paper introduces concepts as: abstract aggregation scheme and aggregation application. Basically, an aggregation application is an application that is obtained by combining corresponding components. In our model an aggregation application is a word in a language.