Search results for "SHIFT"
showing 10 items of 1226 documents
Cathodoluminescence study of undoped GaN films: Experiment and calculation
2009
Abstract In this paper, we report the theoretical and experimental results of cathodoluminescence (CL) from GaN layers grown at 800 °C by metal organic vapor phase epitaxy (MOVPE) on silicon substrate. The CL spectra recorded at room temperature reveal the near band-edge emission at 3.35–3.42 eV and a broad yellow luminescence at 2.2 eV. The CL depth analysis at constant power excitation shows inhomogeneous CL distribution in depth of these emissions as the electron beam increases from 3 to 25 keV. There appears a blue shift of the CL band-edge peaks with increasing sample depth. This behavior is explained by a change of the fundamental band gap due to residual strain and the local temperat…
Nuclear magnetic shielding constants in the CC2 model
1997
Abstract Test calculations of nuclear magnetic shielding constants in the CC2 model are performed using the gauge-including atomic orbital approach. Absolute shielding constants are reported for reprsentative first-row hydrides, a few multiply bonded molecules and some challenging cases. The performance of CC2 is analyzed by comparison with experimental data and results from calculations employing more sophisticated treatments of electron correlation. In most cases, CC2 shieldings and chemical shifts are close to those obtained at second-order perturbation theory, despite the fact that the CC2 model includes an approximate treatment of orbital relaxation effects at the correlated level.
Electron correlation effects on the calculated 13C NMR spectra of vinyl cations
1997
Abstract A study of calculated 13C NMR chemical shifts in vinyl cations is presented. The sensitivity of predicted isotropic shifts to correlation, basis set and geometry effects is explored. In order to obtain accurate estimates that are reasonably well converged with respect to further improvements in theory, it appears that the CCSD(T) method must be used with a basis of triple-zeta plus polarization quality on the carbon atoms. Second-order many-body perturbation theory performs adequately for all carbons except for that bearing the formal positive charge, while the self-consistent field approximation cannot be relied upon to predict even the correct qualitative ordering in the spectrum…
1H nmr chemical shifts of [14]annulenes and their dianion salts
1987
Abstract The bridged (14]annulene 2 was reduced into its dianion and the structure of the dianion salt was proven by chemical and spectroscopic means. The 1H NMR spectroscopic properties of 2 are similar to those of the structurally related bridged [14]annulene 1 , whereas the corresponding dianions 2 2- and 1 2- are strikingly different. The geometries of 1 and 2 and their dianions were studied by means of a modified π-SCF force field approach. Almost planar perimeters without significant bond length alternation are obtained for the neutral annulenes 1 and 2 , whereas their dianions are characterized by structures with reduced symmetry. The 1H chemical shifts of the bridged [14]annulenes a…
Crossing frontiers in biomaterials and regenerative medicine
2008
From 28 May–1 June 2008, the 8th World Biomaterials Congress (WBC) was held in Amsterdam, The Netherlands. The meeting attracted 3052 participants from 82 countries, which has made this congress the largest meeting ever held in the field of biomaterials and regenerative medicine. More than 650 oral and 1500 poster contributions [1] were presented in 108 scientific sessions, divided into nine parallel sessions, including 48 dedicated symposia that had been proposed by international leaders in the field. The symposia each contained an invited keynote, providing expert opinions on current developments in biomaterials research. Historically, research in the field of biomaterials has focused on …
T helper 17 lineage differentiation is programmed by orphan nuclear receptors ROR alpha and ROR gamma.
2007
T cell functional differentiation is mediated by lineage-specific transcription factors. T helper 17 (Th17) has been recently identified as a distinct Th lineage mediating tissue inflammation. Retinoic acid receptor-related orphan receptor gamma (ROR gamma) was shown to regulate Th17 differentiation; ROR gamma deficiency, however, did not completely abolish Th17 cytokine expression. Here, we report Th17 cells highly expressed another related nuclear receptor, ROR alpha, induced by transforming growth factor-beta and interleukin-6 (IL-6), which is dependent on signal transducer and activator of transcription 3. Overexpression of ROR alpha promoted Th17 differentiation, possibly through the c…
Technical-economical evaluation for distributed storage applications. An Italian case study for a medium-scale public facility
2014
Time-of-use energy cost management involves the use of storage by customers to reduce their electricity bills. This can be accomplished by charging the storage during off-peak time periods, when electricity energy prices are low, and discharging it during times when on-peak energy prices are applied. This article addresses the question whether it is economically viable to install medium-scale distributed storage devices in the power system designed to lower the electricity cost for a customer-side application, assuming flexible electricity tariffs. The technical/economical evaluation is carried out referring to Lithium ion (Li-ion), Sodium Sulphur (NaS) and Vanadium Redox Battery (VRB) tech…
New approach for harmonic mitigation in single-phase five-level CHBMI with fundamental frequency switching
2017
The main objective of this paper is to study and analyse the voltage output waveform of a multilevel inverter, to suggest a new approach for harmonic mitigation improving the converter performance. These last type of converters represent a new technology in the field of DC/AC electrical energy conversion, presenting advantages respect to the traditional converters. In fact, the multilevel power converters present a low harmonic content and a high voltage level. The paper considers a five-level single-phase cascaded H-bridge inverter and fundamental frequency modulation techniques. The voltage waveform analysis has allowed to identify a working area of the converter where there are lowest va…
Oil filled MV/LV Power Transformer Behavior in Narrow Band Power Line Communication Systems
2012
The aim of this paper is to characterize oil-filled power transformers in the narrow-band power-line communication (PLC) frequency range of 50-150 kHz. A new model is proposed for such type of a transformer, in the aforementioned frequency range of interest, in order to study its influence on the signal transmission and to investigate the possibility that the PLC signal can cross the power transformer itself. The new model is simpler than those previously proposed in literature, and it can be used in the whole frequency range available for NB PLC according to the CENELEC EN 50065-1 A-band. In order to validate the model, simulation and measurement results are compared for four oil-filled po…
The Luenberger productivity indicator in the water industry: An empirical analysis for England and Wales
2014
Abstract We innovate in the field of water companies' performance with an application of the directional distance function and the Luenberger productivity indicator (LPI) to the assessment of water companies' productivity growth. The advantage of our approach is that it takes into account both input contractions and output expansions. The analysis covered 22 water companies from England and Wales using data over the period 2001–2008. To the best of our knowledge, there are no prior studies applying the Luenberger productivity indicator to the water industry in England and Wales or other countries. For the sake of comparison, the traditional Malmquist productivity index (MPI) was also estima…