Search results for "Correlation"
showing 10 items of 2282 documents
Diffusion of single molecular and macromolecular probes during the free radical bulk polymerization of MMA : towards a better understanding of the Tr…
2016
Free radical bulk polymerizations exhibit complex kinetics due to the viscosity increase during the polymerization process. Especially the termination rate constant can be strongly influenced by the mobility of polymer chains in the polymerization mixture. As a consequence an autoacceleration period, the so-called Trommsdorff effect, can be observed often. In order to investigate this behaviour on a nanoscopic scale, we directly visualized the mobility of molecules and macromolecules in polymerizing MMA solutions using a combination of highly sensitive fluorescence correlation spectroscopy and widefield fluorescence microscopy. For this purpose, rather monodisperse PMMA chains were synthesi…
13C NMR Spin−Lattice Relaxation and Conformational Dynamics in a 1,4-Polybutadiene Melt
2001
We have performed molecular dynamics (MD) simulations of a melt of 1,4-polybutadiene (PBD, 1622 Da) over the temperature range 400-273 K. 13 C NMR spin-lattice relaxation times (T 1 ) and nuclear Overhauser enhancement (NOE) values have been measured from 357 to 272 K for 12 different resonances. The T 1 and NOE values obtained from simulation C-H vector P 2 (t) orientational autocorrelation functions were in good agreement with experiment over the entire temperature range. Analysis of conformational dynamics from MD simulations revealed that T 1 depends much less strongly on the local chain microstructure than does the mean conformational transition time. Spin-lattice relaxation for a give…
Relaxation of self-entangled many-arm star polymers
1989
We present a description of the relaxation of star polymers based on the conformational scaling properties predicted by Daoud and Cotton and confirmed in our recent simulations. We identify three typical relaxation mechanisms. The first describes elastic deformation of the overall shape. Its relaxation time is nearly independent off. A second type of relaxation occurs via rotational diffusion. We predict that the relaxation time should scale with Nwlfz-v where Y is the correlation length exponent. A third relaxation process is the disentanglement of two or more arms. Here the longest relaxation time should increase exponentially with f llz. We measure various relaxation processes by molecul…
Quantum Monte-Carlo calculation of correlation functions of undistorted, cis-distorted and trans-distorted polyacene
2003
Abstract We have studied polyacene within the Hubbard model to explore the effect of electrons correlations on the bond–bond correlation as well as spin–spin correlation functions. We employ the determinantal quantum Monte-Carlo to resolve the microscopic Hamiltonian of this system which involves a nearest-neighbor electron hopping matrix element t , an on-site Coulomb repulsion U . The objective of this study is to understand the effect of electron–electron (e–e) correlations on the structural instability in polyacene. We find strong similarities between polyacene and polyacetylene. The system shows no tendency to destroy the imposed bond-alternation pattern. The spin–spin correlations sho…
HPMA-Based Nanoparticles for Fast, Bioorthogonal iEDDA Ligation
2019
Contains fulltext : 216143.pdf (Publisher’s version ) (Open Access) Fast and bioorthogonally reacting nanoparticles are attractive tools for biomedical applications such as tumor pretargeting. In this study, we designed an amphiphilic block copolymer system based on HPMA using different strategies to introduce the highly reactive click units 1,2,4,5-tetrazines (Tz) either at the chain end (Tz-CTA) or statistical into the hydrophobic block. This reactive group undergoes a rapid, bioorthogonal inverse electron-demand Diels-Alder reaction (iEDDA) with trans-cyclooctenes (TCO). Subsequently, this polymer platform was used for the preparation of different Tz-covered nanoparticles, such as micell…
Aggregation behavior of amphiphilic p(HPMA)-co-p(LMA) copolymers studied by FCS and EPR spectroscopy.
2012
A combined study of fluorescence correlation spectroscopy and electron paramagnetic resonance spectroscopy gave a unique picture of p(HPMA)-co-p(LMA) copolymers in aqueous solutions, ranging from the size of micelles and aggregates to the composition of the interior of these self-assembled systems. P(HPMA)-co-p(LMA) copolymers have shown high potential as brain drug delivery systems, and a detailed study of their physicochemical properties can help to elucidate their mechanism of action. Applying two complementary techniques, we found that the self-assembly behavior as well as the strength of hydrophobic attraction of the amphiphilic copolymers can be tuned by the hydrophobic LMA content or…
A representation of wind velocity by means of fractional spectral moments
2009
This paper deals with the definition of a new function that is a link between Power Spectral Density (PSD) and correlation function, called the Fractional Spectral Moments function. This is defined as the moment of complex order g of the one-sided PSD. It is shown that by means of this complex function both the correlation function and PSD can be represented with great accuracy.
Characteristic time scale of auroral electrojet data
1994
The structure function of the AE time series shows that the AE time series is self-affine such that the scaling exponent changes at the time scale of approximately 113 (±9) minutes. Autocorrelation function is shown to have scaling properties similar to those of the structure function. From this result it can be deduced that the time scale at which the scaling properties of the AE data change should equal the typical autocorrelation time of these data. We find the typical autocorrelation time of the AE data is 118 (±9) minutes. The characteristic time scale of the AE data appears as a spectral break in their power spectrum at a period of about twice the autocorrelation time.
A new representation of power spectral density and correlation function by means of fractional spectral moments
2009
In this paper, a new perspective for the representation of both the power spectral density and the correlation function by a unique class of function is introduced. We define the moments of order gamma (gamma being a complex number) of the one sided power spectral density and we call them Fractional Spectral Moments (FSM). These complex quantities remain finite also in the case in which the ordinary spectral moments diverge, and are able to represent the whole Power Spectral Density and the corresponding correlation function.
The Somatic Symptom Disorder - B Criteria Scale (SSD-12): Factorial structure, validity and population-based norms.
2017
The Somatic Symptom Disorder - B Criteria Scale (SSD-12) assesses the psychological features of DSM-5 Somatic Symptom Disorder (SSD). The present study investigates the dimensionality and psychometric properties in a general population sample and provides norm values.Test dimensionality was evaluated via confirmatory factor analysis and nonparametric item response theory. Correlational analyses and logistic regression models based on related measures (SSS 8, PHQ-2, GAD-2, Health Care Utilization) were used to derive predictive validity. Age and gender specific norms were derived via quantile regression.The SSD-12 has good item characteristics and excellent reliability (Cronbach's α=0.95). C…