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Sample records for 1h transverse relaxation

  1. Transverse relaxation of scalar-coupled protons.

    PubMed

    Segawa, Takuya F; Baishya, Bikash; Bodenhausen, Geoffrey

    2010-10-25

    In a preliminary communication (B. Baishya, T. F. Segawa, G. Bodenhausen, J. Am. Chem. Soc. 2009, 131, 17538-17539), we recently demonstrated that it is possible to obtain clean echo decays of protons in biomolecules despite the presence of homonuclear scalar couplings. These unmodulated decays allow one to determine apparent transverse relaxation rates R(2) (app) of individual protons. Herein, we report the observation of R(2) (app) for three methyl protons, four amide H(N) protons, and all 11 backbone H(α) protons in cyclosporin A. If the proton resonances overlap, their R(2) (app) rates can be measured by transferring their magnetization to neighboring (13)C nuclei, which are less prone to overlap. The R(2) (app) rates of protons attached to (13)C are faster than those attached to (12)C because of (13)C-(1)H dipolar interactions. The differences of these rates allow the determination of local correlation functions. Backbone H(N) and H(α) protons that have fast decay rates R(2) (app) also feature fast longitudinal relaxation rates R(1) and intense NOESY cross peaks that are typical of crowded environments. Variations of R(2) (app) rates of backbone H(α) protons in similar amino acids reflect differences in local environments.

  2. Tacrine derivatives-acetylcholinesterase interaction: 1H NMR relaxation study.

    PubMed

    Delfini, Maurizio; Di Cocco, Maria Enrica; Piccioni, Fabiana; Porcelli, Fernando; Borioni, Anna; Rodomonte, Andrea; Del Giudice, Maria Rosaria

    2007-06-01

    Two acetylcholinesterase (AChE) inhibitors structurally related to Tacrine, 6-methoxytacrine (1a) and 9-heptylamino-6-methoxytacrine (1b), and their interaction with Electrophorus Electricus AChE were investigated. The complete assignment of the 1H and 13C NMR spectra of 1a and 1b was performed by mono-dimensional and homo- and hetero-correlated two-dimensional NMR experiments. This study was undertaken to elucidate the interaction modes between AChE and 1a and 1b in solution, using NMR. The interaction between the two inhibitors and AChE was studied by the analysis of the motional parameters non-selective and selective spin-lattice relaxation times, thereby allowing the motional state of 1a and 1b, both free and bound with AChE, to be defined. The relaxation data pointed out the ligands molecular moiety most involved in the binding with AChE. The relevant ligand/enzyme interaction constants were also evaluated for both compounds and resulted to be 859 and 5412M(-1) for 1a and1b, respectively.

  3. Spin-Lattice Relaxation Times in 1H NMR Spectroscopy.

    ERIC Educational Resources Information Center

    Wink, Donald J.

    1989-01-01

    Discussed are the mechanisms of nuclear magnetic relaxation, and applications of relaxation times. The measurement of spin-lattice relaxations is reviewed. It is stressed that sophisticated techniques such as these are becoming more important to the working chemist. (CW)

  4. Correlation of transverse relaxation time with structure of biological tissue

    NASA Astrophysics Data System (ADS)

    Furman, Gregory B.; Meerovich, Victor M.; Sokolovsky, Vladimir L.

    2016-09-01

    Transverse spin-spin relaxation of liquids entrapped in nanocavities with different orientational order is theoretically investigated. Based on the bivariate normal distribution of nanocavities directions, we have calculated the anisotropy of the transverse relaxation time for biological systems, such as collagenous tissues, articular cartilage, and tendon. In the framework of the considered model, the dipole-dipole interaction is determined by a single coupling constant. The calculation results for the transverse relaxation time explain the angular dependence observed in MRI experiments with biological objects. The good agreement with the experimental data is obtained by adjustment of only one parameter which characterizes the disorder in fiber orientations. The relaxation time is correlated with the degree of ordering in biological tissues. Thus, microstructure of the tissues can be revealed from the measurement of relaxation time anisotropy. The clinical significance of the correlation, especially in the detection of damage must be evaluated in a large prospective clinical trials.

  5. 1H nuclear spin relaxation of liquid water from molecular dynamics simulations.

    PubMed

    Calero, C; Martí, J; Guàrdia, E

    2015-02-01

    We have investigated the nuclear spin relaxation properties of (1)H in liquid water with the help of molecular dynamics simulations. We have computed the (1)H nuclear spin relaxation times T1 and T2 and determined the contribution of the different interactions to the relaxation at different temperatures and for different classical water models (SPC/E, TIP3P, TIP4P, and TIP4P/2005). Among the water models considered, the TIP4P/2005 model exhibits the best agreement with the experiment. The same analysis was performed with Car-Parrinello ab initio molecular dynamics simulations of bulk water at T = 330 K, which provided results close to the experimental values at room temperature. To complete the study, we have successfully accounted for the temperature-dependence of T1 and T2 in terms of a simplified model, which considers the reorientation in finite angle jumps and the diffusive translation of water molecules.

  6. 1H NMR Relaxation Investigation of Inhibitors Interacting with Torpedo californica Acetylcholinesterase

    NASA Astrophysics Data System (ADS)

    Delfini, Maurizio; Gianferri, Raffaella; Dubbini, Veronica; Manetti, Cesare; Gaggelli, Elena; Valensin, Gianni

    2000-05-01

    Two naphthyridines interacting with Torpedo californica acetylcholinesterase (AChE) were investigated. 1H NMR spectra were recorded and nonselective, selective, and double-selective spin-lattice relaxation rates were measured. The enhancement of selective relaxation rates could be titrated by different ligand concentrations at constant AChE (yielding 0.22 and 1.53 mM for the dissociation constants) and was providing evidence of a diverse mode of interaction. The double-selective relaxation rates were used to evaluate the motional correlation times of bound ligands at 34.9 and 36.5 ns at 300 K. Selective relaxation rates of bound inhibitors could be interpreted also in terms of dipole-dipole interactions with protons in the enzyme active site.

  7. Distributions of transverse relaxation times for soft-solids measured in strongly inhomogeneous magnetic fields.

    PubMed

    Chelcea, R I; Fechete, R; Culea, E; Demco, D E; Blümich, B

    2009-02-01

    The single-sided NMR-MOUSE sensor that operates in highly inhomogeneous magnetic fields is used to record a CPMG (1)H transverse relaxation decay by CPMG echo trains for a series of cross-linked natural rubber samples. Effective transverse relaxation rates 1/T(2,short) and 1/T(2,long) were determined by a bi-exponential fit. A linear dependence of transverse relaxation rates on cross-link density is observed for medium to large values of cross-link density. As an alternative to multi-exponential fits the possibility to analyze the dynamics of soft polymer network in terms of multi-exponential decays via the inverse Laplace transformation was studied. The transient regime and the effect of the T(1)/T(2) ratio in inhomogeneous static and radiofrequency magnetic fields on the CPMG decays were studied numerically using a dedicated C++ program to simulate the temporal and spatial dependence of the CPMG response. A correction factor T(2)/T(2,eff) is derived as a function of the T(1)/T(2) ratio from numerical simulations and compared with earlier results from two different well logging devices. High-resolution T(1)-T(2) correlations maps are obtained by two-dimensional Laplace inversion of CPMG detected saturation recovery curves. The T(1)-T(2) experimental correlations maps were corrected for the T(1)/T(2) effect using the derived T(2)/T(2,eff) correction factor.

  8. (1)H-(14)N cross-relaxation spectrum analysis in sildenafil and sildenafil citrate.

    PubMed

    Gregorovič, Alan; Apih, Tomaž; Seliger, Janez

    2016-09-01

    Here we describe a method for the extraction of (14)N quadrupole parameters from a (1)H-(14)N cross-relaxation spectrum by fitting the lineshapes of the (14)N quadrupole transitions. The procedures used typically to fit quadrupole lineshapes are not directly applicable to fit the (1)H-(14)N cross-relaxation spectrum, because the presence of proton homonuclear dipolar interaction broadens the lineshapes considerably and prevents a reliable determination of Cq and η from a single lineshape. Instead, one must fit two or even three lineshapes originating from the same nitrogen site simultaneously. The problem is to identify which lineshapes belong together when many are observed due to the existence of several nitrogen sites. We solve this problem by fitting the spectrum for all possible combinations and find the best-fitting one. This combination then most likely correctly identifies lineshapes belonging to the same nitrogen site. There are two main advantages of our method compared to the typically used method, which relies only on lineshape singularities: (i) the method is "automatic" and does not require knowledge of nitrogen quadrupole parameters in similar environments to aid dip pairing and (ii) the accuracy of quadrupole parameters is better, as proton linewidth is included in the fits. We use sildenafil and sildenafil citrate as model compounds, each with six non-equivalent nitrogen sites.

  9. (1)H-(14)N cross-relaxation spectrum analysis in sildenafil and sildenafil citrate.

    PubMed

    Gregorovič, Alan; Apih, Tomaž; Seliger, Janez

    2016-09-01

    Here we describe a method for the extraction of (14)N quadrupole parameters from a (1)H-(14)N cross-relaxation spectrum by fitting the lineshapes of the (14)N quadrupole transitions. The procedures used typically to fit quadrupole lineshapes are not directly applicable to fit the (1)H-(14)N cross-relaxation spectrum, because the presence of proton homonuclear dipolar interaction broadens the lineshapes considerably and prevents a reliable determination of Cq and η from a single lineshape. Instead, one must fit two or even three lineshapes originating from the same nitrogen site simultaneously. The problem is to identify which lineshapes belong together when many are observed due to the existence of several nitrogen sites. We solve this problem by fitting the spectrum for all possible combinations and find the best-fitting one. This combination then most likely correctly identifies lineshapes belonging to the same nitrogen site. There are two main advantages of our method compared to the typically used method, which relies only on lineshape singularities: (i) the method is "automatic" and does not require knowledge of nitrogen quadrupole parameters in similar environments to aid dip pairing and (ii) the accuracy of quadrupole parameters is better, as proton linewidth is included in the fits. We use sildenafil and sildenafil citrate as model compounds, each with six non-equivalent nitrogen sites. PMID:27379753

  10. /sup 1/H and /sup 13/C spin-lattice relaxation in gaseous benzene

    SciTech Connect

    Folkendt, M.M.; Weiss-Lopez, B.E.; True, N.S.

    1988-08-25

    The nuclear spin-lattice relaxation time, T/sub 1/, measured for benzene protons at densities between 0.81 and 54.4 mol/m/sup 3/ (15 and 980 Torr) at 381 K exhibits a characteristic nonlinear density dependence. Analysis of the density-dependent T/sub 1/ data yields a spin-rotation coupling constant, C/sub eff/, of /vert bar/182.6 (0.4)/vert bar/ Hz and an angular momentum reorientation cross section, sigma, of 131 (1) /Angstrom//sup 2/. The /sup 13/C spin-lattice relaxation time of singly labeled /sup 13/C benzene is a linear function of density over the density range 1.07-75.12 mol/m/sup 3/ (20-1330 Torr). /sup 13/C T/sub 1/ values are shorter than /sup 1/H T/sub 1/ values by a factor of ca. 100 at comparable densities. The nuclear Overhauser enhancement factor, /eta/, is 0.0 /plus minus/ 0.02 at densities between 11 and 85.3 mol/m/sup 3/ (200 and 1500 Torr), demonstrating that dipole-dipole relaxation is relatively inefficient in this region. The spin-rotation coupling constant, C/sub eff/, for /sup 13/C nuclei in benzene is estimated to be /vert bar/1602 (68)/vert bar/ Hz.

  11. A fast determination method for transverse relaxation of spin-exchange-relaxation-free magnetometer

    SciTech Connect

    Lu, Jixi Qian, Zheng; Fang, Jiancheng

    2015-04-15

    We propose a fast and accurate determination method for transverse relaxation of the spin-exchange-relaxation-free (SERF) magnetometer. This method is based on the measurement of magnetic resonance linewidth via a chirped magnetic field excitation and the amplitude spectrum analysis. Compared with the frequency sweeping via separate sinusoidal excitation, our method can realize linewidth determination within only few seconds and meanwhile obtain good frequency resolution. Therefore, it can avoid the drift error in long term measurement and improve the accuracy of the determination. As the magnetic resonance frequency of the SERF magnetometer is very low, we include the effect of the negative resonance frequency caused by the chirp and achieve the coefficient of determination of the fitting results better than 0.998 with 95% confidence bounds to the theoretical equation. The experimental results are in good agreement with our theoretical analysis.

  12. A fast determination method for transverse relaxation of spin-exchange-relaxation-free magnetometer.

    PubMed

    Lu, Jixi; Qian, Zheng; Fang, Jiancheng

    2015-04-01

    We propose a fast and accurate determination method for transverse relaxation of the spin-exchange-relaxation-free (SERF) magnetometer. This method is based on the measurement of magnetic resonance linewidth via a chirped magnetic field excitation and the amplitude spectrum analysis. Compared with the frequency sweeping via separate sinusoidal excitation, our method can realize linewidth determination within only few seconds and meanwhile obtain good frequency resolution. Therefore, it can avoid the drift error in long term measurement and improve the accuracy of the determination. As the magnetic resonance frequency of the SERF magnetometer is very low, we include the effect of the negative resonance frequency caused by the chirp and achieve the coefficient of determination of the fitting results better than 0.998 with 95% confidence bounds to the theoretical equation. The experimental results are in good agreement with our theoretical analysis.

  13. Nuclear magnetic resonance transverse relaxation in muscle water.

    PubMed Central

    Fung, B M; Puon, P S

    1981-01-01

    The origin of the nonexponentiality of proton spin echoes of skeletal muscle has been carefully examined. It is shown that the slowly decaying part of the proton spin echoes is not due to extracellular water. First, for muscle from mice with in vivo deuteration, the deuteron spin echoes were also nonexponential, but the slowly decaying part had a larger weighing factor. Second, for glycerinated muscle in which cell membranes were disrupted, the proton spin echoes were similar to those in intact muscle. Third, the nonexponentiality of the proton spin echoes in intact muscle increased when postmortem rigor set in. Finally, when the lifetimes of extracellular water and intracellular water were taken into account in the exchange, it was found that the two types of water would not give two resolvable exponentials with the observed decay constants. It is suggested that the unusually short T2's and the nonexponential character of the spin echoes of proton and deuteron in muscle water are mainly due to hydrogen exchange between water and functional groups in the protein filaments. These groups have large dipolar or quadrupolar splittings, and undergo hydrogen exchange with water at intermediate rates. The exchange processes and their effects on the spin echoes are pH-dependent. The dependence of transverse relaxation of pH was observed in glycerinated rabbit psoas muscle fibers. PMID:7272437

  14. The effect of fast electronic relaxation times on the 1H and 7Li magnetic relaxation dispersion modulated by the translational encounter of cation/cation pairs

    NASA Astrophysics Data System (ADS)

    Dinesen, T. R. J.; Bryant, R. G.

    1999-04-01

    1H and 7Li magnetic relaxation dispersion data are presented, showing the field dependence of the spin-lattice relaxation rates of (H 3C) 4N + and Li(H 2O) n+ in Gd(III) and Mn(II) solutions. The limit of short electronic relaxation time is observed for Gd(III) up to about 7 T, in contrast to Mn(II) solutions wherein the intermolecular contribution to nuclear relaxation is dominated by relative translational diffusion. These results contradict the assumption made by Fries et al. (Chem. Phys. Lett. 286 (1998) 93) that the electron relaxation times may be neglected in the analysis of tetramethylammonium proton relaxation rates in Gd(III) solutions.

  15. Relationship between the crystallization rates of amorphous nifedipine, phenobarbital, and flopropione, and their molecular mobility as measured by their enthalpy relaxation and (1)H NMR relaxation times.

    PubMed

    Aso, Y; Yoshioka, S; Kojima, S

    2000-03-01

    Isothermal crystallization of amorphous nifedipine, phenobarbital, and flopropione was studied at temperatures above and below their glass transition temperatures (T(g)). A sharp decrease in the crystallization rate with decreasing temperature was observed for phenobarbital and flopropione, such that no crystallization was observed at temperatures 20-30 degrees C lower than their T(g) within ordinary experimental time periods. In contrast, the crystallization rate of nifedipine decreased moderately with decreasing temperature, and considerable crystallization was observed at 40 degrees C below its T(g) within 4 months. The molecular mobility of these amorphous drugs was assessed by enthalpy relaxation and (1)H-NMR relaxation measurements. The enthalpy relaxation time of nifedipine was smaller than that of phenobarbital or flopropinone at the same T - T(g) values, suggesting higher molecular mobility of nifedipine. The spin-lattice relaxation time in the rotating frame (T(1rho)) decreased markedly at temperature above T(g). The slope of the Arrhenius type plot of the T(1rho) for nifedipine protons changed at about 10 degrees C below the T(g), whereas the slope for phenobarbital protons became discontinuous at about 10 degrees C above the T(g). Even at temperatures below its T(g), the spin-spin relaxation process of nifedipine could be described by the sum of its Gaussian relaxation, which is characteristic of solid protons, and its Lorentzian relaxation, which is characteristic of protons with higher mobility. In contrast, no Lorentzian relaxation was observed for phenobarbital or flopropione at temperatures below their T(g). These results also suggest that nifedipine has higher molecular mobility than phenobarbital and flopropione at temperatures below T(g). The faster crystallization of nifedipine than that of phenobarbital or flopropione observed at temperatures below its T(g) may be partly ascribed to its higher molecular mobility at these temperatures.

  16. A study of the aging of silicone breast implants using 29Si, 1H relaxation and DSC measurements.

    PubMed

    Birkefeld, Anja Britta; Eckert, Hellmut; Pfleiderer, Bettina

    2004-08-01

    In this study 26 previously implanted silicone breast implants from the same manufacturer (Dow Corning) were investigated with two different analytical methods to characterize potential aging processes such as migration of monomer material from the gel and shell to local and distant sites, chemical alterations of the polymer, and infiltration of body compounds such as lipids. (1)H and (29)Si NMR relaxation measurements (spin-lattice, T1, and spin-spin, T2, relaxation times) were used to study the molecular dynamics of polysiloxane chains, both in gels and in shells. In addition, changes in physical properties were monitored by differential scanning calorimetry (DSC). The results of these measurements indicate that NMR relaxation times are influenced by implant generation, implantation time, shell texture and implant status. (1)H T2 values of shells and gels show a tendency to increase with increasing implantation time, indicating higher mobility and possible disintegration of the polymer network of older implants. Furthermore, the data suggest that aging also involves the migration of low cyclic molecular weight (LMW) silicone and linear chain polymer material from the gels into the shells. The high "bleeding" rate of second-generation (G2) implants (implantation period around 1973-1985), exhibiting thin shells is reflected in reduced relaxation times of these devices, most likely due to a loss of low molecular weight fractions from the gels. Moreover, "gel bleeding" also influences the melting behavior observed in DSC studies. Increased shell rigidity (high Tm and Tg) tends to be correlated with longer (29)Si relaxation times of the corresponding gels, suggesting a reduced transfer of LMW silicones and linear chain polymer from the gel to the shell and to the outside. Remarkably, textured implants seem to be less susceptible to degradation processes than implants with thin shells.

  17. Preserving the excitation profile of small flip angle RF pulses in the presence of rapid transverse relaxation.

    PubMed

    Shen, Jun

    2012-11-01

    Degradation of excitation profile of selective RF pulses by rapid transverse relaxation has been a long-standing concern. In this report we demonstrate that transverse relaxation can be incorporated into small flip angle RF pulse design based on the linear response theory. Small flip angle pulses that were designed without considering transverse relaxation effects can be transformed for a predefined pulse duration/T(2) ratio. The transformed pulses, within the realm of the linear response theory, produce the same transverse frequency response as if there were no relaxation.

  18. 7Li relaxation time measurements at very low magnetic field by 1H dynamic nuclear polarization

    NASA Astrophysics Data System (ADS)

    Zeghib, Nadir; Grucker, Daniel

    2001-09-01

    Dynamic nuclear polarization (DNP) of water protons was used to measure the relaxation time of lithium at very low magnetic field as a demonstration of the use of DNP for nuclei less abundant than water protons. Lithium (Li+) was chosen because it is an efficient treatment for manic-depressive illness, with an unknown action mechanism. After having recalled the theoretical basis of a three-spin system comprising two nuclei - the water proton of the solvent, the dissolved Li+ ion and the free electron of a free radical - we have developed a transient solution in order to optimize potential biological applications of Li DNP. The three-spin model has allowed computation of all the parameters of the system - the longitudinal relaxation rate per unit of free radical concentration, the dipolar and scalar part of the coupling between the nuclei and the electron, and the maximum signal enhancement achievable for both proton and lithium spins. All these measurements have been obtained solely through the detection of the proton resonance.

  19. Localized T2 measurements using an OSIRIS-CPMG method. Application to measurements of blood oxygenation and transverse relaxation free of diffusion effect.

    PubMed

    Girard, F; Poulet, P; Namer, I J; Steibel, J; Chambron, J

    1994-12-01

    This work presents a new method allowing localized T2 measurements, based upon the OSIRIS scheme. A train of 180 degrees pulses is applied after the OSIRIS preparation cycle, recording directly the transverse magnetization decay. The method was verified for two nuclei, 1H and 19F, with phantoms and in vivo on rats. The accuracy of the T2 values is discussed, as well as possible applications of the OSIRIS-CPMG method to proton transverse spin relaxation measurements, free of diffusion effects, and to non-invasive in vivo blood oxygenation measurements, through the use of an emulsion of perfluorooctylbromide, a blood substitute containing fluorine.

  20. Magnetic hyperthermia efficiency and (1)H-NMR relaxation properties of iron oxide/paclitaxel-loaded PLGA nanoparticles.

    PubMed

    Ruggiero, Maria R; Crich, Simonetta Geninatti; Sieni, Elisabetta; Sgarbossa, Paolo; Forzan, Michele; Cavallari, Eleonora; Stefania, Rachele; Dughiero, Fabrizio; Aime, Silvio

    2016-07-15

    Magnetic iron oxide nanoparticles (Fe-NPs) can be exploited in biomedicine as agents for magnetic fluid hyperthermia (MFH) treatments and as contrast enhancers in magnetic resonance imaging. New, oleate-covered, iron oxide particles have been prepared either by co-precipitation or thermal decomposition methods and incorporated into poly(lactic-co-glycolic acid) nanoparticles (PLGA-Fe-NPs) to improve their biocompatibility and in vivo stability. Moreover, the PLGA-Fe-NPs have been loaded with paclitaxel to pursue an MFH-triggered drug release. Remarkably, it has been found that the nanoparticle formulations are characterized by peculiar (1)H nuclear magnetic relaxation dispersion (NMRD) profiles that directly correlate with their heating potential when exposed to an alternating magnetic field. By prolonging the magnetic field exposure to 30 min, a significant drug release was observed for PLGA-Fe-NPs in the case of the larger-sized magnetic nanoparticles. Furthermore, the immobilization of lipophilic Fe-NPs in PLGA-NPs also made it possible to maintain Néel relaxation as the dominant relaxation contribution in the presence of large iron oxide cores (diameters of 15-20 nm), with the advantage of preserving their efficiency when they are entrapped in the intracellular environment. The results reported herein show that NMRD profiles are a useful tool for anticipating the heating capabilities of Fe-NPs designed for MFH applications. PMID:27265726

  1. Magnetic hyperthermia efficiency and 1H-NMR relaxation properties of iron oxide/paclitaxel-loaded PLGA nanoparticles

    NASA Astrophysics Data System (ADS)

    Ruggiero, Maria R.; Geninatti Crich, Simonetta; Sieni, Elisabetta; Sgarbossa, Paolo; Forzan, Michele; Cavallari, Eleonora; Stefania, Rachele; Dughiero, Fabrizio; Aime, Silvio

    2016-07-01

    Magnetic iron oxide nanoparticles (Fe-NPs) can be exploited in biomedicine as agents for magnetic fluid hyperthermia (MFH) treatments and as contrast enhancers in magnetic resonance imaging. New, oleate-covered, iron oxide particles have been prepared either by co-precipitation or thermal decomposition methods and incorporated into poly(lactic-co-glycolic acid) nanoparticles (PLGA-Fe-NPs) to improve their biocompatibility and in vivo stability. Moreover, the PLGA-Fe-NPs have been loaded with paclitaxel to pursue an MFH-triggered drug release. Remarkably, it has been found that the nanoparticle formulations are characterized by peculiar 1H nuclear magnetic relaxation dispersion (NMRD) profiles that directly correlate with their heating potential when exposed to an alternating magnetic field. By prolonging the magnetic field exposure to 30 min, a significant drug release was observed for PLGA-Fe-NPs in the case of the larger-sized magnetic nanoparticles. Furthermore, the immobilization of lipophilic Fe-NPs in PLGA-NPs also made it possible to maintain Néel relaxation as the dominant relaxation contribution in the presence of large iron oxide cores (diameters of 15-20 nm), with the advantage of preserving their efficiency when they are entrapped in the intracellular environment. The results reported herein show that NMRD profiles are a useful tool for anticipating the heating capabilities of Fe-NPs designed for MFH applications.

  2. Magnetic hyperthermia efficiency and 1H-NMR relaxation properties of iron oxide/paclitaxel-loaded PLGA nanoparticles

    NASA Astrophysics Data System (ADS)

    Ruggiero, Maria R.; Geninatti Crich, Simonetta; Sieni, Elisabetta; Sgarbossa, Paolo; Forzan, Michele; Cavallari, Eleonora; Stefania, Rachele; Dughiero, Fabrizio; Aime, Silvio

    2016-07-01

    Magnetic iron oxide nanoparticles (Fe-NPs) can be exploited in biomedicine as agents for magnetic fluid hyperthermia (MFH) treatments and as contrast enhancers in magnetic resonance imaging. New, oleate-covered, iron oxide particles have been prepared either by co-precipitation or thermal decomposition methods and incorporated into poly(lactic-co-glycolic acid) nanoparticles (PLGA-Fe-NPs) to improve their biocompatibility and in vivo stability. Moreover, the PLGA-Fe-NPs have been loaded with paclitaxel to pursue an MFH-triggered drug release. Remarkably, it has been found that the nanoparticle formulations are characterized by peculiar 1H nuclear magnetic relaxation dispersion (NMRD) profiles that directly correlate with their heating potential when exposed to an alternating magnetic field. By prolonging the magnetic field exposure to 30 min, a significant drug release was observed for PLGA-Fe-NPs in the case of the larger-sized magnetic nanoparticles. Furthermore, the immobilization of lipophilic Fe-NPs in PLGA-NPs also made it possible to maintain Néel relaxation as the dominant relaxation contribution in the presence of large iron oxide cores (diameters of 15–20 nm), with the advantage of preserving their efficiency when they are entrapped in the intracellular environment. The results reported herein show that NMRD profiles are a useful tool for anticipating the heating capabilities of Fe-NPs designed for MFH applications.

  3. General solution to gradient-induced transverse and longitudinal relaxation of spins undergoing restricted diffusion

    NASA Astrophysics Data System (ADS)

    Zheng, W.; Gao, H.; Liu, J.-G.; Zhang, Y.; Ye, Q.; Swank, C.

    2011-11-01

    We develop an approach, by calculating the autocorrelation function of spins, to derive the magnetic field gradient-induced transverse (T2) relaxation of spins undergoing restricted diffusion. This approach is an extension to the method adopted by McGregor. McGregor's approach solves the problem only in the fast diffusion limit; however, our approach yields a single analytical solution suitable in all diffusion regimes, including the intermediate regime. This establishes a direct connection between the well-known slow diffusion result of Torrey and the fast diffusion result. We also perform free induction decay measurements on spin-exchange optically polarized 3He gas with different diffusion constants. The measured transverse relaxation profiles are compared with the theory and satisfactory agreement has been found throughout all diffusion regimes. In addition to the transverse relaxation, this approach is also applicable to solving the longitudinal relaxation (T1) regardless of the diffusion limits. It turns out that the longitudinal relaxation in the slow diffusion limit differs by a factor of 2 from that in the fast diffusion limit.

  4. Direct Visualization of Short Transverse Relaxation Time Component (ViSTa)

    PubMed Central

    Oh, Se-Hong; Bilello, Michel; Schindler, Matthew; Markowitz, Clyde E.; Detre, John A.; Lee, Jongho

    2013-01-01

    White matter of the brain has been demonstrated to have multiple relaxation components. Among them, the short transverse relaxation time component (T2 < 40 ms; T2* < 25 ms at 3T) has been suggested to originate from myelin water whereas long transverse relaxation time components have been associated with axonal and/or interstitial water. In myelin water imaging, T2 or T2* signal decay is measured to estimate myelin water fraction based on T2 or T2* differences among the water components. This method has been demonstrated to be sensitive to demyelination in the brain but suffers from low SNR and image artifacts originating from ill-conditioned multi-exponential fitting. In this study, a novel approach that selectively acquires short transverse relaxation time signal is proposed. The method utilizes a double inversion RF pair to suppress a range of long T1 signal. This suppression leaves short T2* signal, which has been suggested to have short T1, as the primary source of the image. The experimental results confirms that after suppression of long T1 signals, the image is dominated by short T2* in the range of myelin water, allowing us to directly visualize the short transverse relaxation time component in the brain. Compared to conventional myelin water imaging, this new method of direct visualization of short relaxation time component (ViSTa) provides high quality images. When applied to multiple sclerosis patients, chronic lesions show significantly reduced signal intensity in ViSTa images suggesting sensitivity to demyelination. PMID:23796545

  5. Direct visualization of short transverse relaxation time component (ViSTa).

    PubMed

    Oh, Se-Hong; Bilello, Michel; Schindler, Matthew; Markowitz, Clyde E; Detre, John A; Lee, Jongho

    2013-12-01

    White matter of the brain has been demonstrated to have multiple relaxation components. Among them, the short transverse relaxation time component (T2<40 ms; T2⁎<25 ms at 3 T) has been suggested to originate from myelin water whereas long transverse relaxation time components have been associated with axonal and/or interstitial water. In myelin water imaging, T2 or T2⁎ signal decay is measured to estimate myelin water fraction based on T2 or T2⁎ differences among the water components. This method has been demonstrated to be sensitive to demyelination in the brain but suffers from low SNR and image artifacts originating from ill-conditioned multi-exponential fitting. In this study, a novel approach that selectively acquires short transverse relaxation time signal is proposed. The method utilizes a double inversion RF pair to suppress a range of long T1 signal. This suppression leaves short T2⁎ signal, which has been suggested to have short T1, as the primary source of the image. The experimental results confirm that after suppression of long T1 signals, the image is dominated by short T2⁎ in the range of myelin water, allowing us to directly visualize the short transverse relaxation time component in the brain. Compared to conventional myelin water imaging, this new method of direct visualization of short relaxation time component (ViSTa) provides high quality images. When applied to multiple sclerosis patients, chronic lesions show significantly reduced signal intensity in ViSTa images suggesting sensitivity to demyelination.

  6. Changes of the local pore space structure quantified in heterogeneous porous media by 1H magnetic resonance relaxation tomography

    NASA Astrophysics Data System (ADS)

    Borgia, G. C.; Bortolotti, V.; Fantazzini, P.

    2001-08-01

    Magnetic resonance imaging and relaxation analysis are combined in a spatially resolved technique (relaxation tomography), which is able to quantify the parameters connected to the local structure in the internal regions of a porous material saturated by water, giving information on the pore space structure beyond the nominal instrumental resolution. Voxel-by-voxel longitudinal (T1) and transverse (T2) relaxation curves are acquired in order to obtain T1, T2 and S(0) maps, where S(0) is the extrapolation to zero time of the total equilibrium magnetization corrected for T2 decay. The proposed method permits evaluation of the porosity (ratio of pore space to total volume), at different length scales, from the sample to the voxel, not all achievable by traditional methods. More striking is its ability to describe how porosity is shared among different classes of surface-to-volume ratios of diffusion cells (the regions that the individual water molecules, starting at their particular positions, can experience by diffusion before relaxing). This is a consequence of the fact that relaxation times of water confined in a porous material can, under favorable circumstances, distinguish regions with the same local porosity but with different pore sizes and connections. So, parameters can be introduced, such as the microporosity fraction, defined as the fraction of the "micropore" volume with respect to the total pore volume, and several voxel average porosities, defined as the average porosities of the voxels characterized by particular classes of diffusion cells. Moreover, the imaging methods enable us to get all this information in a user-defined region of interest. The method has been applied to quantify changes in the structure of carbonate cores with wide distributions of pore sizes induced by repeated cycles of freezing and heating of the sample. With freezing, the microporosity fraction decreases significantly; the voxel average porosity of voxels with T1 shorter than

  7. SU-E-I-64: Transverse Relaxation Time in Methylene Protons of Non-Alcoholic Fatty Liver Disease Rats

    SciTech Connect

    Song, K-H; Lee, D-W; Choe, B-Y

    2015-06-15

    Purpose: The aim of this study was to evaluate transverse relaxation time of methylene resonance compared to other lipid resonances. Methods: The examinations were performed using a 3.0 T scanner with a point — resolved spectroscopy (PRESS) sequence. Lipid relaxation time in a lipid phantom filled with canola oil was estimated considering repetition time (TR) as 6000 msec and echo time (TE) as 40 — 550 msec. For in vivo proton magnetic resonance spectroscopy ({sup 1}H — MRS), eight male Sprague — Dawley rats were given free access to a normal - chow (NC) and eight other male Sprague-Dawley rats were given free access to a high — fat (HF) diet. Both groups drank water ad libitum. T{sub 2} measurements in the rats’ livers were conducted at a fixed TR of 6000 msec and TE of 40 – 220 msec. Exponential curve fitting quality was calculated through the coefficients of determination (R{sup 2}). Results: A chemical analysis of phantom and liver was not performed but a T{sub 2} decay curve was acquired. The T{sub 2} relaxation time of methylene resonance was estimated as follows: NC rats, 37.07 ± 4.32 msec; HF rats, 31.43 ± 1.81 msec (p < 0.05). The extrapolated M0 values were higher in HF rats than in NC rats (p < 0.005). Conclusion: This study of {sup 1}H-MRS led to sufficient spectral resolution and signal — to — noise ratio differences to characterize all observable resonances for yielding T{sub 2} relaxation times of methylene resonance. {sup 1}H — MRS relaxation times may be useful for quantitative characterization of various liver diseases, including fatty liver disease. This study was supported by grant (2012-007883 and 2014R1A2A1A10050270) from the Mid-career Researcher Program through the NRF funded by Ministry of Science. In addition, this study was supported by the Industrial R&D of MOTIE/KEIT (10048997, Development of the core technology for integrated therapy devices based on real-time MRI-guided tumor tracking)

  8. An approximate analytical expression for the nuclear quadrupole transverse relaxation rate of half-integer spins in liquids.

    PubMed

    Wu, Gang

    2016-08-01

    The nuclear quadrupole transverse relaxation process of half-integer spins in liquid samples is known to exhibit multi-exponential behaviors. Within the framework of Redfield's relaxation theory, exact analytical expressions for describing such a process exist only for spin-3/2 nuclei. As a result, analyses of nuclear quadrupole transverse relaxation data for half-integer quadrupolar nuclei with spin >3/2 must rely on numerical diagonalization of the Redfield relaxation matrix over the entire motional range. In this work we propose an approximate analytical expression that can be used to analyze nuclear quadrupole transverse relaxation data of any half-integer spin in liquids over the entire motional range. The proposed equation yields results that are in excellent agreement with the exact numerical calculations. PMID:27343483

  9. ESR lineshape and {sup 1}H spin-lattice relaxation dispersion in propylene glycol solutions of nitroxide radicals – Joint analysis

    SciTech Connect

    Kruk, D.; Hoffmann, S. K.; Goslar, J.; Lijewski, S.; Kubica-Misztal, A.; Korpała, A.; Oglodek, I.; Moscicki, J.; Kowalewski, J.; Rössler, E. A.

    2013-12-28

    Electron Spin Resonance (ESR) spectroscopy and Nuclear Magnetic Relaxation Dispersion (NMRD) experiments are reported for propylene glycol solutions of the nitroxide radical: 4-oxo-TEMPO-d{sub 16} containing {sup 15}N and {sup 14}N isotopes. The NMRD experiments refer to {sup 1}H spin-lattice relaxation measurements in a broad frequency range (10 kHz–20 MHz). A joint analysis of the ESR and NMRD data is performed. The ESR lineshapes give access to the nitrogen hyperfine tensor components and the rotational correlation time of the paramagnetic molecule. The NMRD data are interpreted in terms of the theory of paramagnetic relaxation enhancement in solutions of nitroxide radicals, recently presented by Kruk et al. [J. Chem. Phys. 138, 124506 (2013)]. The theory includes the effect of the electron spin relaxation on the {sup 1}H relaxation of the solvent. The {sup 1}H relaxation is caused by dipole-dipole interactions between the electron spin of the radical and the proton spins of the solvent molecules. These interactions are modulated by three dynamic processes: relative translational dynamics of the involved molecules, molecular rotation, and electron spin relaxation. The sensitivity to rotation originates from the non-central positions of the interacting spin in the molecules. The electronic relaxation is assumed to stem from the electron spin–nitrogen spin hyperfine coupling, modulated by rotation of the radical molecule. For the interpretation of the NMRD data, we use the nitrogen hyperfine coupling tensor obtained from ESR and fit the other relevant parameters. The consistency of the unified analysis of ESR and NMRD, evaluated by the agreement between the rotational correlation times obtained from ESR and NMRD, respectively, and the agreement of the translation diffusion coefficients with literature values obtained for pure propylene glycol, is demonstrated to be satisfactory.

  10. The effect of noncollinearity of 15N-1H dipolar and 15N CSA tensors and rotational anisotropy on 15N relaxation, CSA/dipolar cross correlation, and TROSY.

    PubMed

    Fushman, D; Cowburn, D

    1999-02-01

    Current approaches to 15N relaxation in proteins assume that the 15N-1H dipolar and 15N CSA tensors are collinear. We show theoretically that, when there is significant anisotropy of molecular rotation, different orientations of the two tensors, experimentally observed in proteins, nucleic acids, and small peptides, will result in differences in site-specific correlation functions and spectral densities. The standard treatments of the rates of longitudinal and transverse relaxation of amide 15N nuclei, of the 15N CSA/15N-1H dipolar cross correlation, and of the TROSY experiment are extended to account for the effect of noncollinearity of the 15N-1H dipolar and 15N CSA (chemical shift anisotropy) tensors. This effect, proportional to the degree of anisotropy of the overall motion, (D parallel/D perpendicular - 1), is sensitive to the relative orientation of the two tensors and to the orientation of the peptide plane with respect to the diffusion coordinate frame. The effect is negligible at small degrees of anisotropy, but is predicted to become significant for D parallel/D perpendicular > or = 1.5, and at high magnetic fields. The effect of noncollinearity of 15N CSA and 15N-1H dipolar interaction is sensitive to both gross (hydrodynamic) properties and atomic-level details of protein structure. Incorporation of this effect into relaxation data analysis is likely to improve both precision and accuracy of the derived characteristics of protein dynamics, especially at high magnetic fields and for molecules with a high degree of anisotropy of the overall motion. The effect will also make TROSY efficiency dependent on local orientation in moderately anisotropic systems.

  11. Separation of the longitudinal and transverse cross sections in the {sup 1}H(e,e{prime} K{sup +}){Lambda} and {sup 1}H(e,e{prime} K{sup +}){Sigma}{sup 0} reactions

    SciTech Connect

    R.M. Mohring; David Abbott; Abdellah Ahmidouch; Thomas Amatuni; Pawel Ambrozewicz; Tatiana Angelescu; Christopher Armstrong; John Arrington; Ketevi Assamagan; Steven Avery; Kevin Bailey; Kevin Beard; S Beedoe; Elizabeth Beise; Herbert Breuer; Roger Carlini; Jinseok Cha; C. Chang; Nicholas Chant; Evaristo Cisbani; Glenn Collins; William Cummings; Samuel Danagoulian; Raffaele De Leo; Fraser Duncan; James Dunne; Dipangkar Dutta; T Eden; Rolf Ent; Laurent Eyraud; Lars Ewell; John Finn; H. Terry Fortune; Valera Frolov; Salvatore Frullani; Christophe Furget; Franco Garibaldi; David Gaskell; Donald Geesaman; Paul Gueye; Kenneth Gustafsson; Jens-Ole Hansen; Mark Harvey; Wendy Hinton; Ed Hungerford; Mauro Iodice; Ceasar Jackson; Cynthia Keppel; Wooyoung Kim; Kouichi Kino; Douglas Koltenuk; Serge Kox; Laird Kramer; Antonio Leone; Allison Lung; David Mack; Richard Madey; M Maeda; Stanislaw Majewski; Pete Markowitz; T Mart; C Martoff; David Meekins; A. Mihul; Joseph Mitchell; Hamlet Mkrtchyan; Sekazi Mtingwa; Maria-Ioana Niculescu; R. Perrino; David Potterveld; John Price; Brian Raue; Jean Sebastien Real; Joerg Reinhold; Philip Roos; Teijiro Saito; Geoff Savage; Reyad Sawafta; Ralph Segel; Stepan Stepanyan; Paul Stoler; Vardan Tadevosyan; Liguang Tang; Liliana Teodorescu; Tatsuo Terasawa; Hiroaki Tsubota; Guido Urciuoli; Jochen Volmer; William Vulcan; T. Welch; Robert Williams; Stephen Wood; Chen Yan; Benjamin Zeidman

    2003-05-19

    We report measurements of cross sections for the reaction {sup 1}H(e,e{prime} K{sup +})Y, for both the {Lambda} and {Sigma}{sup 0} hyperon states, at an invariant mass of W = 1.84 GeV and four-momentum transfers 0.5 < Q{sup 2} < 2 (GeV/c){sup 2}. Data were taken for three values of virtual photon polarization {epsilon}, allowing the decomposition of the cross sections into longitudinal and transverse components. The {Lambda} data are a revised analysis of prior work, whereas the {Sigma}{sup 0} results have not been previously reported.

  12. A theoretical and numerical consideration of the longitudinal and transverse relaxations in the rotating frame.

    PubMed

    Murase, Kenya

    2013-11-01

    We previously derived a simple equation for solving time-dependent Bloch equations by a matrix operation. The purpose of this study was to present a theoretical and numerical consideration of the longitudinal (R1ρ=1/T1ρ) and transverse relaxation rates in the rotating frame (R2ρ=1/T2ρ), based on this method. First, we derived an equation describing the time evolution of the magnetization vector (M(t)) by expanding the matrix exponential into the eigenvalues and the corresponding eigenvectors using diagonalization. Second, we obtained the longitudinal magnetization vector in the rotating frame (M1ρ(t)) by taking the inner product of M(t) and the eigenvector with the smallest eigenvalue in modulus, and then we obtained the transverse magnetization vector in the rotating frame (M2ρ(t)) by subtracting M1ρ(t) from M(t). For comparison, we also computed the spin-locked magnetization vector. We derived the exact solutions for R1ρ and R2ρ from the eigenvalues, and compared them with those obtained numerically from M1ρ(t) and M2ρ(t), respectively. There was excellent agreement between them. From the exact solutions for R1ρ and R2ρ, R2ρ was found to be given by R2ρ=(2R2+R1)/2-R1ρ/2, where R1 and R2 denote the conventional longitudinal and transverse relaxation rates, respectively. We also derived M1ρ(t) and M2ρ(t) for bulk water protons, in which the effect of chemical exchange was taken into account using a 2-pool chemical exchange model, and we compared the R1ρ and R2ρ values obtained from the eigenvalues and those obtained numerically from M1ρ(t) and M2ρ(t). There was also excellent agreement between them. In conclusion, this study will be useful for better understanding of the longitudinal and transverse relaxations in the rotating frame and for analyzing the contrast mechanisms in T1ρ- and T2ρ-weighted MRI.

  13. The search for negative amplitude components in quasi-continuous distributions of relaxation times: the example of 1H magnetization exchange in articular cartilage and hydrated collagen

    NASA Astrophysics Data System (ADS)

    Fantazzini, Paola; Galassi, Francesca; Bortolotti, Villiam; Brown, Robert J. S.; Vittur, Franco

    2011-06-01

    When inverting nuclear magnetic resonance relaxation data in order to obtain quasi-continuous distributions of relaxation times for fluids in porous media, it is common practice to impose a non-negative (NN) constraint on the distributions. While this approach can be useful in reducing the effects of data distortion and/or preventing wild oscillations in the distributions, it may give misleading results in the presence of real negative amplitude components. Here, some examples of valid negative components for articular cartilage and hydrated collagen are given. Articular cartilage is a connective tissue, consisting mainly of collagen, proteoglycans and water, which can be considered, in many aspects, as a porous medium. Separate T1 relaxation data are obtained for low-mobility ('solid') macromolecular 1H and for higher-mobility ('liquid') 1H by the separation of these components in free induction decays, with α denoting the solid/liquid 1H ratio. When quasi-continuous distributions of relaxation times (T1) of the solid and liquid signal components of cartilage or collagen are computed from experimental relaxation data without imposing the usual NN constraint, valid negative peaks may appear. The features of the distributions, in particular negative peaks, and the fact that peaks at longer times for macromolecular and water protons are at essentially the same T1, are interpreted as the result of a magnetization exchange between these two spin pools. For the only-slightly-hydrated collagen samples, with α>1, the exchange leads to small negative peaks at short T1 times for the macromolecular component. However, for the cartilage, with substantial hydration or for a strongly hydrated collagen sample, both with αLt1, the behavior is reversed, with a negative peak for water at short times. The validity of a negative peak may be accepted (dismissed) by a high (low) cost of NN in error of fit. Computed distributions for simulated data using observed signal

  14. Measurement of longitudinal relaxation times in crowded 1H NMR spectra using one- and two-dimensional maximum quantum (MAXY) NMR spectroscopy

    NASA Astrophysics Data System (ADS)

    Liu, Maili; Ye, Chaohui; Farrant, R. Duncan; Nicholson, Jeremy K.; Lindon, John C.

    Methods for measuring longitudinal relaxation times of protons in heavily overlapped 1H NMR spectra are introduced and exemplified using a solution of cholesteryl acetate. The methods are based on 1-dimensional and 2-dimensional maximum quantum NMR spectroscopy (MAXY), which makes possible the selective detection of CH, CH2 and CH31H NMR resonances. A modification of the BIRD pulse sequence to achieve selective inversion of protons bonded to either 12C or 13C is given. The approach should find application in studies of molecular dynamics where isotopic enrichment is not possible and the level of available sample dictates the use of 1H NMR spectroscopy.

  15. Aqueous suspensions of polymer coated magnetite nanoparticles: Colloidal stability, specific absorption rate, and transverse relaxivity

    NASA Astrophysics Data System (ADS)

    Saville, Steven Lee

    The design, functionalization, characterization, and applications of magnetic nanoparticles have garnered significant interest over the past several decades. While this area has garnered increasing attention, several questions remain unanswered about the stability of these systems and it's influence on their biomedical applications. To help answer these questions about the stability of these, a novel tri(nitroDOPA) terminated polymer based ligand has been developed for the stabilization of magnetite nanoparticles. The synthesis involves a process in which ethylene oxide is polymerized using a trivinyl initiator, modified with carboxylic acid using a free radical addition of mercaptoundecanoic acid, and then functionalized with nitroDOPA using N,N-dicyclohexylcarbodiimide (DCC) and N-hydroxysuccinimide (NHS) chemistry. This polymer has displayed robust adhesion even in harsh chemical environments, out performing many polymers used today for the stabilization of magnetite. Along these same lines, the effects of instability of these systems were analyzed in both MRI and magnetic hyperthermia applications. It is widely known that formation of linear aggregates (i.e. chains) occurs in more concentrated ferrofluids systems and that this has an affect on the ferrofluid properties. It has been recently reported that for some suspensions of magnetic nanoparticles the transverse proton relaxation rate, R2, is dependent on the time that the sample is exposed to an applied magnetic field. This time dependence has been linked to the formation of linear aggregates or chains in an applied magnetic field via numerical modeling. In this work the relationships between colloidal stability, the formation of these linear structures, and changes observed in the proton transverse relaxation rate and heating rate in magnetic hyperthermia of aqueous suspensions of magnetic particles are examined. The results indicate that varying the ligand length has a direct effect on the colloidal

  16. The Effect of Iron in MR Imaging and Transverse Relaxation of Amyloid-Beta Plaques in Alzheimer’s Disease

    PubMed Central

    Meadowcroft, Mark D.; Peters, Douglas G.; Dewal, Rahul; Connor, James R.; Yang, Qing X.

    2015-01-01

    Dysregulation of neural iron is known to occur during the progression of Alzheimer’s disease. Visualization of amyloid-beta (Aβ) plaques with magnetic resonance imaging (MRI) has largely been credited to rapid proton relaxation in the vicinity of plaques due to focal iron deposition. The goal of this work was to determine the relationship between local relaxation and related focal iron content associated with Aβ plaques. Alzheimer’s disease (N=5) and control tissue (N=3) sample slices from the entorhinal cortex were treated overnight with the iron chelator deferoxamine or saline and had microscopic gradient-echo MRI datasets taken. Subsequent to imaging, the same slices were stained for Aβ and iron then compared to parametric R2* relaxation maps and gradient-echo weighted MR images. Aβ plaques in both chelated and un-chelated tissue generated MR hypo-intensities and had relaxation rates significantly greater than the surrounding tissue. The transverse relaxation rate associated with amyloid plaques was determined not to be solely due to iron load, as much of the relaxation associated with Aβ plaques remained following iron chelation. The data indicate a dual relaxation mechanism associated with Aβ plaques such that iron and plaque composition synergistically produce transverse relaxation. PMID:25530083

  17. WATER AND METABOLITE TRANSVERSE T2 RELAXATION TIME ABNORMALITIES IN THE WHITE MATTER IN SCHIZOPHRENIA

    PubMed Central

    Du, Fei; Cooper, Alissa; Cohen, Bruce M.; Renshaw, Perry F.; Öngür, Dost

    2012-01-01

    Multiple lines of evidence suggest that microstructural abnormalities in the white matter are important in the pathophysiology of schizophrenia. Diffusion MRI approaches which can provide evidence on tissue structure have been widely used to probe these abnormalities in vivo, but transverse relaxation times (T2) may provide additional insights since they are determined by molecule-microenvironment interactions not revealed by diffusion MRI. T2 of water – located both intra and extracellularly – and N-acetylaspartate (NAA – located intracellularly) reflect related but distinct processes due to their differential localization and interactions with other molecules. In this study, we collected water and NAA T2 data from 16 healthy subjects (HC), and 16 patients with schizophrenia (SZ) at 4 Tesla in a 9cc voxel in the right prefrontal white matter. The SZ group had longer water but shorter NAA T2 relaxation times when compared with the HC group. This pattern resulted in a statistically significant metabolite x group interaction (F(18,1):4.980, p=0.039). Prolongation of water T2 and shortening of NAA T2 is consistent with an impoverishment of white matter macromolecule structures (including myelin) and abnormal intra-axonal milieu and volume in SZ. PMID:22356802

  18. 1H and 19F spin-lattice relaxation and CH3 or CF3 reorientation in molecular solids containing both H and F atoms

    NASA Astrophysics Data System (ADS)

    Beckmann, Peter A.; Rheingold, Arnold L.

    2016-04-01

    The dynamics of methyl (CH3) and fluoromethyl (CF3) groups in organic molecular (van der Waals) solids can be exploited to survey their local environments. We report solid state 1H and 19F spin-lattice relaxation experiments in polycrystalline 3-trifluoromethoxycinnamic acid, along with an X-ray diffraction determination of the molecular and crystal structure, to investigate the intramolecular and intermolecular interactions that determine the properties that characterize the CF3 reorientation. The molecule is of no particular interest; it simply provides a motionless backbone (on the nuclear magnetic resonance (NMR) time scale) to investigate CF3 reorientation occurring on the NMR time scale. The effects of 19F-19F and 19F-1H spin-spin dipolar interactions on the complicated nonexponential NMR relaxation provide independent inputs into determining a model for CF3 reorientation. As such, these experiments provide much more information than when only one spin species (usually 1H) is present. In Sec. IV, which can be read immediately after the Introduction without reading the rest of the paper, we compare the barrier to CH3 and CF3 reorientation in seven organic solids and separate this barrier into intramolecular and intermolecular components.

  19. The effect of magnetically induced linear aggregates on proton transverse relaxation rates of aqueous suspensions of polymer coated magnetic nanoparticles.

    PubMed

    Saville, Steven L; Woodward, Robert C; House, Michael J; Tokarev, Alexander; Hammers, Jacob; Qi, Bin; Shaw, Jeremy; Saunders, Martin; Varsani, Rahi R; St Pierre, Tim G; Mefford, O Thompson

    2013-03-01

    It has been recently reported that for some suspensions of magnetic nanoparticles the transverse proton relaxation rate, R(2), is dependent on the time that the sample is exposed to an applied magnetic field. This time dependence has been linked to the formation of linear aggregates or chains in an applied magnetic field via numerical modeling. It is widely known that chain formation occurs in more concentrated ferrofluids systems and that this has an affect on the ferrofluid properties. In this work we examine the relationships between colloidal stability, the formation of these linear structures, and changes observed in the proton transverse relaxation rate of aqueous suspensions of magnetic particles. A series of iron oxide nanoparticles with varying stabilizing ligand brush lengths were synthesized. These systems were characterized with dynamic light scattering, transmission electron microscopy, dark-field optical microscopy, and proton transverse relaxation rate measurements. The dark field optical microscopy and R(2) measurements were made in similar magnetic fields over the same time scale so as to correlate the reduction of the transverse relaxivity with the formation of linear aggregates. Our results indicate that varying the ligand length has a direct effect on the colloidal arrangement of the system in a magnetic field, producing differences in the rate and size of chain formation, and hence systematic changes in transverse relaxation rates over time. With increasing ligand brush length, attractive inter-particle interactions are reduced, which results in slower aggregate formation and shorter linear aggregate length. These results have implications for the stabilization, characterization and potentially the toxicity of magnetic nanoparticle systems used in biomedical applications. PMID:23389324

  20. Understanding generalized inversions of nuclear magnetic resonance transverse relaxation time in porous media.

    PubMed

    Mitchell, J; Chandrasekera, T C

    2014-12-14

    The nuclear magnetic resonance transverse relaxation time T2, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T2 provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T2 distributions demands appropriate processing of the measured data since T2 is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form -ante(k) (where n is the number and te the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T2 distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries. PMID:25494741

  1. Understanding generalized inversions of nuclear magnetic resonance transverse relaxation time in porous media.

    PubMed

    Mitchell, J; Chandrasekera, T C

    2014-12-14

    The nuclear magnetic resonance transverse relaxation time T2, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T2 provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T2 distributions demands appropriate processing of the measured data since T2 is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form -ante(k) (where n is the number and te the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T2 distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries.

  2. Understanding generalized inversions of nuclear magnetic resonance transverse relaxation time in porous media

    NASA Astrophysics Data System (ADS)

    Mitchell, J.; Chandrasekera, T. C.

    2014-12-01

    The nuclear magnetic resonance transverse relaxation time T2, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T2 provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T2 distributions demands appropriate processing of the measured data since T2 is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form -ant_e^k (where n is the number and te the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T2 distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries.

  3. Understanding generalized inversions of nuclear magnetic resonance transverse relaxation time in porous media

    SciTech Connect

    Mitchell, J.; Chandrasekera, T. C.

    2014-12-14

    The nuclear magnetic resonance transverse relaxation time T{sub 2}, measured using the Carr-Purcell-Meiboom-Gill (CPMG) experiment, is a powerful method for obtaining unique information on liquids confined in porous media. Furthermore, T{sub 2} provides structural information on the porous material itself and has many applications in petrophysics, biophysics, and chemical engineering. Robust interpretation of T{sub 2} distributions demands appropriate processing of the measured data since T{sub 2} is influenced by diffusion through magnetic field inhomogeneities occurring at the pore scale, caused by the liquid/solid susceptibility contrast. Previously, we introduced a generic model for the diffusion exponent of the form −ant{sub e}{sup k} (where n is the number and t{sub e} the temporal separation of spin echoes, and a is a composite diffusion parameter) in order to distinguish the influence of relaxation and diffusion in CPMG data. Here, we improve the analysis by introducing an automatic search for the optimum power k that best describes the diffusion behavior. This automated method is more efficient than the manual trial-and-error grid search adopted previously, and avoids variability through subjective judgments of experimentalists. Although our method does not avoid the inherent assumption that the diffusion exponent depends on a single k value, we show through simulation and experiment that it is robust in measurements of heterogeneous systems that violate this assumption. In this way, we obtain quantitative T{sub 2} distributions from complicated porous structures and demonstrate the analysis with examples of ceramics used for filtration and catalysis, and limestone of relevance to the construction and petroleum industries.

  4. Induced Clustered Nanoconfinement of Superparamagnetic Iron Oxide in Biodegradable Nanoparticles Enhances Transverse Relaxivity for Targeted Theranostics

    PubMed Central

    Ragheb, Ragy R. T.; Kim, Dongin; Bandyopadhyay, Arunima; Chahboune, Halima; Bulutoglu, Beyza; Ezaldein, Harib; Criscione, Jason M.; Fahmy, Tarek M.

    2013-01-01

    Purpose Combined therapeutic and diagnostic agents, “theranostics” are emerging valuable tools for noninvasive imaging and drug delivery. Here, we report on a solid biodegradable multifunctional nanoparticle that combines both features. Methods Poly(lactide-co-glycolide) nanoparticles were engineered to confine superparamagnetic iron oxide contrast for magnetic resonance imaging while enabling controlled drug delivery and targeting to specific cells. To achieve this dual modality, fatty acids were used as anchors for surface ligands and for encapsulated iron oxide in the polymer matrix. Results We demonstrate that fatty acid modified iron oxide prolonged retention of the contrast agent in the polymer matrix during degradative release of drug. Antibody-fatty acid surface modification facilitated cellular targeting and subsequent internalization in cells while inducing clustering of encapsulated fatty-acid modified superparamagnetic iron oxide during particle formulation. This induced clustered confinement led to an aggregation within the nanoparticle and, hence, higher transverse relaxivity, r2, (294 mM−1 s−1) compared with nanoparticles without fatty-acid ligands (160 mM−1 s−1) and higher than commercially available superparamagnetic iron oxide nanoparticles (89 mM−1 s−1). Conclusion Clustering of superparamagnetic iron oxide in poly(lactide-co-glycolide) did not affect the controlled release of encapsulated drugs such as methotrexate or clodronate and their subsequent pharmacological activity, thus highlighting the full theranostic capability of our system. PMID:23401099

  5. Scaling of transverse nuclear magnetic relaxation due to magnetic nanoparticle aggregation.

    PubMed

    Brown, Keith A; Vassiliou, Christophoros C; Issadore, David; Berezovsky, Jesse; Cima, Michael J; Westervelt, R M

    2010-10-01

    The aggregation of superparamagnetic iron oxide (SPIO) nanoparticles decreases the transverse nuclear magnetic resonance (NMR) relaxation time T2CP of adjacent water molecules measured by a Carr-Purcell-Meiboom-Gill (CPMG) pulse-echo sequence. This effect is commonly used to measure the concentrations of a variety of small molecules. We perform extensive Monte Carlo simulations of water diffusing around SPIO nanoparticle aggregates to determine the relationship between T2CP and details of the aggregate. We find that in the motional averaging regime T2CP scales as a power law with the number N of nanoparticles in an aggregate. The specific scaling is dependent on the fractal dimension d of the aggregates. We find T2CP∝N-0.44 for aggregates with d = 2.2, a value typical of diffusion limited aggregation. We also find that in two-nanoparticle systems, T2CP is strongly dependent on the orientation of the two nanoparticles relative to the external magnetic field, which implies that it may be possible to sense the orientation of a two-nanoparticle aggregate. To optimize the sensitivity of SPIO nanoparticle sensors, we propose that it is best to have aggregates with few nanoparticles, close together, measured with long pulse-echo times. PMID:20689678

  6. Longitudinal and Transverse Cross Sections in the {sup 1}H ({ital e},thinspthinsp {ital e}{sup {prime}}{ital K}{sup +}){Lambda} Reaction

    SciTech Connect

    Niculescu, G.; Gueye, P.; Ahmidouch, A.; Assamagan, K.; Avery, S.; Baker, O.K.; Beard, K.; Cha, J.; Eden, T.; Harvey, M.; Hinton, W.; Keppel, C.; Madey, R.; Niculescu, I.; Savage, G.; Tang, L.; Williams, R.; Mohring, R.M.; Beise, E.; Breuer, H.; Chang, C.C.; Chant, N.; Collins, G.; Duncan, F.; Ewell, L.; Gustafsson, K.K.; Lung, A.; Roos, P.; Abbott, D.; Baker, O.K.; Carlini, R.; Dunne, J.; Ent, R.; Keppel, C.; Mack, D.; Majewski, S.; Mitchell, J.; Tang, L.; Vulcan, W.; Wood, S.; Yan, C.; Ahmidouch, A.; Madey, R.; Amatuni, T.A.; Mkrtchyan, H.; Stepanyan, S.; Tadevosian, V.; Ambrozewicz, P.; Martoff, C.J.; Angelescu, T.; Mihul, A.; Teodorescu, L.; Armstrong, C.S.; Finn, M.; Meekins, D.; Bailey, K.; Cummings, W.; Geesaman, D.F.; Hansen, J.; Potterveld, D.; Reinhold, J.; Zeidman, B.; Beedoe, S.; Danagoulian, S.; Jackson, C.; Mtingwa, S.; Sawafta, R.; Volmer, J.; Cisbani, E.; De Leo, R.; Frullani, S.; Garibaldi, F.; Iodice, M.; Leone, T.; Lolos, G.; Perrino, R.; Urciuoli, G.M.; Dutta, D.; Segel, R.; Eyraud, L.; Furget, C.; Kox, S.; Real, J.

    1998-08-01

    The {sup 1}H( e,thinspe{sup {prime}}K{sup +}){Lambda} reaction was studied as a function of the squared four-momentum transfer, Q{sup 2} , and the virtual photon polarization, {var_epsilon} . For each of four Q{sup 2} settings, 0.52, 0.75, 1.00, and 2.00 (GeV/c){sup 2} , the longitudinal and transverse virtual photon cross sections were extracted in measurements at three virtual photon polarizations. The Q{sup 2} dependence of the {sigma}{sub L}/{sigma}{sub T} ratio differs significantly from current theoretical predictions. This, combined with the precision of the measurement, implies a need for revision of existing calculations. {copyright} {ital 1998} {ital The American Physical Society }

  7. Mechanical Impedance of the Non-loaded Lower Leg with Relaxed Muscles in the Transverse Plane

    PubMed Central

    Ficanha, Evandro Maicon; Ribeiro, Guilherme Aramizo; Rastgaar, Mohammad

    2015-01-01

    This paper describes the protocols and results of the experiments for the estimation of the mechanical impedance of the humans’ lower leg in the External–Internal direction in the transverse plane under non-load bearing condition and with relaxed muscles. The objectives of the estimation of the lower leg’s mechanical impedance are to facilitate the design of passive and active prostheses with mechanical characteristics similar to the humans’ lower leg, and to define a reference that can be compared to the values from the patients suffering from spasticity. The experiments were performed with 10 unimpaired male subjects using a lower extremity rehabilitation robot (Anklebot, Interactive Motion Technologies, Inc.) capable of applying torque perturbations to the foot. The subjects were in a seated position, and the Anklebot recorded the applied torques and the resulting angular movement of the lower leg. In this configuration, the recorded dynamics are due mainly to the rotations of the ankle’s talocrural and the subtalar joints, and any contribution of the tibiofibular joints and knee joint. The dynamic mechanical impedance of the lower leg was estimated in the frequency domain with an average coherence of 0.92 within the frequency range of 0–30 Hz, showing a linear correlation between the displacement and the torques within this frequency range under the conditions of the experiment. The mean magnitude of the stiffness of the lower leg (the impedance magnitude averaged in the range of 0–1 Hz) was determined as 4.9 ± 0.74 Nm/rad. The direct estimation of the quasi-static stiffness of the lower leg results in the mean value of 5.8 ± 0.81 Nm/rad. An analysis of variance shows that the estimated values for the stiffness from the two experiments are not statistically different. PMID:26697424

  8. Mechanical Impedance of the Non-loaded Lower Leg with Relaxed Muscles in the Transverse Plane.

    PubMed

    Ficanha, Evandro Maicon; Ribeiro, Guilherme Aramizo; Rastgaar, Mohammad

    2015-01-01

    This paper describes the protocols and results of the experiments for the estimation of the mechanical impedance of the humans' lower leg in the External-Internal direction in the transverse plane under non-load bearing condition and with relaxed muscles. The objectives of the estimation of the lower leg's mechanical impedance are to facilitate the design of passive and active prostheses with mechanical characteristics similar to the humans' lower leg, and to define a reference that can be compared to the values from the patients suffering from spasticity. The experiments were performed with 10 unimpaired male subjects using a lower extremity rehabilitation robot (Anklebot, Interactive Motion Technologies, Inc.) capable of applying torque perturbations to the foot. The subjects were in a seated position, and the Anklebot recorded the applied torques and the resulting angular movement of the lower leg. In this configuration, the recorded dynamics are due mainly to the rotations of the ankle's talocrural and the subtalar joints, and any contribution of the tibiofibular joints and knee joint. The dynamic mechanical impedance of the lower leg was estimated in the frequency domain with an average coherence of 0.92 within the frequency range of 0-30 Hz, showing a linear correlation between the displacement and the torques within this frequency range under the conditions of the experiment. The mean magnitude of the stiffness of the lower leg (the impedance magnitude averaged in the range of 0-1 Hz) was determined as 4.9 ± 0.74 Nm/rad. The direct estimation of the quasi-static stiffness of the lower leg results in the mean value of 5.8 ± 0.81 Nm/rad. An analysis of variance shows that the estimated values for the stiffness from the two experiments are not statistically different.

  9. MRI of bone marrow in the distal radius: in vivo precision of effective transverse relaxation times

    NASA Technical Reports Server (NTRS)

    Grampp, S.; Majumdar, S.; Jergas, M.; Lang, P.; Gies, A.; Genant, H. K.

    1995-01-01

    The effective transverse relaxation time T2* is influenced by the presence of trabecular bone, and can potentially provide a measure of bone density as well as bone structure. We determined the in vivo precision of T2* in repeated bone marrow measurements. The T2* measurements of the bone marrow of the distal radius were performed twice within 2 weeks in six healthy young volunteers using a modified water-presaturated 3D Gradient-Recalled Acquisition at Steady State (GRASS) sequence with TE 7, 10, 12, 20, and 30; TR 67; flip angle (FA) 90 degrees. An axial volume covering a length of 5.6 cm in the distal radius was measured. Regions of interest (ROIs) were determined manually and consisted of the entire trabecular bone cross-section extending proximally from the radial subchondral endplate. Reproducibility of T2* and area measurements was expressed as the absolute precision error (standard deviation [SD] in ms or mm2) or as the relative precision error (SD/mean x 100, or coefficient of variation [CV] in %) between the two-point measurements. Short-term precision of T2* and area measurements varied depending on section thickness and location of the ROI in the distal radius. Absolute precision errors for T2* times were between 1.3 and 2.9 ms (relative precision errors 3.8-9.5 %) and for area measurements between 20 and 55 mm2 (relative precision errors 5.1-16.4%). This MR technique for quantitative assessment of trabecular bone density showed reasonable reproducibility in vivo and is a promising future tool for the assessment of osteoporosis.

  10. A simulation based method to assess inversion algorithms for transverse relaxation data

    NASA Astrophysics Data System (ADS)

    Ghosh, Supriyo; Keener, Kevin M.; Pan, Yong

    2008-04-01

    NMR relaxometry is a very useful tool for understanding various chemical and physical phenomena in complex multiphase systems. A Carr-Purcell-Meiboom-Gill (CPMG) [P.T. Callaghan, Principles of Nuclear Magnetic Resonance Microscopy, Clarendon Press, Oxford, 1991] experiment is an easy and quick way to obtain transverse relaxation constant (T2) in low field. Most of the samples usually have a distribution of T2 values. Extraction of this distribution of T2s from the noisy decay data is essentially an ill-posed inverse problem. Various inversion approaches have been used to solve this problem, to date. A major issue in using an inversion algorithm is determining how accurate the computed distribution is. A systematic analysis of an inversion algorithm, UPEN [G.C. Borgia, R.J.S. Brown, P. Fantazzini, Uniform-penalty inversion of multiexponential decay data, Journal of Magnetic Resonance 132 (1998) 65-77; G.C. Borgia, R.J.S. Brown, P. Fantazzini, Uniform-penalty inversion of multiexponential decay data II. Data spacing, T2 data, systematic data errors, and diagnostics, Journal of Magnetic Resonance 147 (2000) 273-285] was performed by means of simulated CPMG data generation. Through our simulation technique and statistical analyses, the effects of various experimental parameters on the computed distribution were evaluated. We converged to the true distribution by matching up the inversion results from a series of true decay data and a noisy simulated data. In addition to simulation studies, the same approach was also applied on real experimental data to support the simulation results.

  11. Self-Assembly of Peptide Amphiphiles Designed as Imaging Probes for 19F and Relaxation-Enhanced 1H imaging

    NASA Astrophysics Data System (ADS)

    Preslar, Adam Truett

    This work incorporates whole-body imaging functionality into peptide amphiphile (PA) nanostructures used for regenerative medicine to facilitate magnetic resonance imaging (MRI). Two strategies were employed: 1. Conjugation of gadolinium chelates to peptide nanostructures to monitor biomaterial degradation in vivo with MRI and inductively-coupled plasma-mass spectroscopy (ICP-MS) 2. Synthesis of perfluorinated moiety-bearing peptide amphiphiles for 19F-MRI. The Gd(III) chelate gadoteridol was conjugated by copper-catalyzed "click" chemistry to a series of PAs known to form cylindrical nanostructures. By fitting nuclear magnetic resonance dispersion (NMRD) profiles to the Solomon-Bloembergen-Morgan (SBM) equations, it was observed that the water exchange parameter (tauM) depended on thermal annealing or calcium ion cross-linking. The sequence C16V 3A3E3G(Gd) exhibited an acceleration of nearly 100 ns after thermal annealing and calcium addition. These gadolinium-labeled PAs were used to track in vivo degradation of gels within the tibialis anterior muscle in a murine model. The half-life of biomaterial degradation was determined to be 13.5 days by inductively coupled plasma mass spectrometry (ICP-MS) of Gd(III). Gel implants could be monitored by MRI for eight days before the signal dispersed due to implant degradation and dilution. Additionally, nanostructures incorporating highly fluorinated domains were investigated for use as MRI contrast agents. Short, perfluoroalkyane tails of seven or eight carbon atoms in length were grafted to PA sequences containing a V2A2 beta-sheet forming sequence. The V2A2 sequence is known to drive 1D nanostructure assembly. It was found that the sequences C7F13V2A 2E2 and C7F13V2A 2K3 formed 1D assemblies in water which transition from ribbon-like to cylindrical shape as pH increases from 4.5 to 8.0. Ribbon-like nanostructures had reduced magnetic resonance signal by T 2 relaxation quenching, whereas their cylindrical counterparts

  12. Effect of gel firmness at cutting time, pH, and temperature on rennet coagulation and syneresis: an in situ 1H NMR relaxation study.

    PubMed

    Hansen, Christian Lyndgaard; Rinnan, Asmund; Engelsen, Søren Balling; Janhøj, Thomas; Micklander, Elisabeth; Andersen, Ulf; van den Berg, Frans

    2010-01-13

    The objective of this study was to monitor rennet-induced milk gel formation and mechanically induced gel syneresis in situ by low-field NMR. pH, temperature, and gel firmness at cutting time were varied in a factorial design. The new curve-fitting method Doubleslicing revealed that during coagulation two proton populations with distinct transverse relaxation times (T2,1=181, T2,2=465 ms) were present in fractions (f1=98.9%, f2=1.1%). Mechanical cutting of the gel in the NMR tube induced macrosyneresis, which led to the appearance of an additional proton population (T2,3=1500-2200 ms) identified as whey. On the basis of NMR quantification of whey water the syneresis rate was calculated and found to be significantly dependent on pH and temperature.

  13. Conformational stability and thermal pathways of relaxation in triclosan (antibacterial/excipient/contaminant) in solid-state: combined spectroscopic ((1)H NMR) and computational (periodic DFT) study.

    PubMed

    Latosińska, Jolanta Natalia; Latosińska, Magdalena; Tomczak, Marzena Agnieszka; Medycki, Wojciech

    2015-05-21

    The mechanism of molecular dynamics in the antibacterial/antifungal agent, triclosan (5-chloro-2-(2',4'-dichlorophenoxy)-phenol), in solid state was studied by (1)H NMR spectroscopy and periodic density functional theory (DFT) calculations. Temperature dependencies of the proton spin-lattice relaxation time (T1) in the ranges 86-293 and 90-250 K (at 15 and 24.667 MHz, respectively) and the second moment (M2) of the (1)H NMR resonant line in the range 103-300 K were measured. Two minima in the temperature dependence of T1 revealed a classical Arrhenius governed activation processes. The low temperature shallow minimum T1(T) of 71 s at 115 K, 15 MHz, which shifts with frequency, was assigned to classical hindered jumps of hydroxyl group around OC axis and with respect to a 5-chloro-2-phenol ring. The activation energy of this motion estimated on the basis of the fit of the theoretical model to the experimental points is 9.68 kJ/mol. The pointed high temperature minimum T1(T) of 59 s at 190 K, 15 MHz, which also shifts with frequency, was assigned to the small angle librations by Θlib= ± 9° between two positions of equilibrium differing in energy by 7.42 kJ/mol. The activation energy of this motion estimated on the basis of the fit of the theoretical model to the experimental points is 31.1 kJ/mol. Both motions result in a negligible reduction in the (1)H NMR line second moment, thus the second moment delivers an irrelevant description of the molecular motions in triclosan.

  14. Analysis of 31P MAS NMR spectra and transversal relaxation of bacteriophage M13 and tobacco mosaic virus.

    PubMed Central

    Magusin, P C; Hemminga, M A

    1994-01-01

    Phosphorus magic angle spinning nuclear magnetic resonance (NMR) spectra and transversal relaxation of M13 and TMV are analyzed by use of a model, which includes both local backbone motions of the encapsulated nucleic acid molecules and overall rotational diffusion of the rod-shaped virions about their length axis. Backbone motions influence the sideband intensities by causing a fast restricted reorientation of the phosphodiesters. To evaluate their influence on the observed sideband patterns, we extend the model that we used previously to analyze nonspinning 31P NMR lineshapes (Magusin, P.C.M.M., and M. A. Hemminga. 1993a. Biophys. J. 64:1861-1868) to magic angle spinning NMR experiments. Backbone motions also influence the conformation of the phosphodiesters, causing conformational averaging of the isotropic chemical shift, which offers a possible explanation for the various linewidths of the centerband and the sidebands observed for M13 gels under various conditions. The change of the experimental lineshape of M13 as a function of temperature and hydration is interpreted in terms of fast restricted fluctuation of the dihedral angles between the POC and the OCH planes on both sides of the 31P nucleus in the nucleic acid backbone. Backbone motions also seem to be the main cause of transversal relaxation measured at spinning rates of 4 kHz or higher. At spinning rates less than 2 kHz, transversal relaxation is significantly faster. This effect is assigned to slow, overall rotation of the rod-shaped M13 phage about its length axis. Equations are derived to simulate the observed dependence of T2e on the spinning rate. PMID:8038391

  15. Characterizing longitudinal and transverse relaxation rates of ferrofluids in microtesla magnetic fields

    NASA Astrophysics Data System (ADS)

    Chen, Ming-Jye; Liao, Shu-Hsien; Yang, Hong-Chang; Lee, Hsin-Yi; Liu, Yi-Jia; Chen, Hsin-Hsien; Horng, Herng-Er; Yang, Shieh-Yueh

    2011-12-01

    Shortening spin-lattice relaxation rates (1/T1) or spin-spin relaxation rates (1/T2) is the purpose of magnetic resonance imaging contrast agents. In this work, an ultralow field nuclear magnetic resonance spectrometer and imager are set up to characterize the spin relaxation rates of Fe3O4 superparamagnetic iron oxide (SPIO) for image contrast. It was found that both 1/T1 and 1/T2 increase linearly when the magnetic susceptibility χ of SPIO increases by increasing the concentration of SPIO dispersed in water. In an applied field, magnetic moments of SPIO generate microscopic field gradients that weaken the field homogeneity, in turn de-phasing the proton's nuclear spin and enhancing the relaxation rates. A T1-contrast image is demonstrated, using SPIO as the contrast agent and high-Tc superconducting quantum interference devices as the detector. T1-contrast imaging in microtesla fields might provide a potential modality for discriminating cancer.

  16. Reducing the inversion degree of MnFe2O4 nanoparticles through synthesis to enhance magnetization: evaluation of their (1)H NMR relaxation and heating efficiency.

    PubMed

    Vamvakidis, K; Katsikini, M; Sakellari, D; Paloura, E C; Kalogirou, O; Dendrinou-Samara, C

    2014-09-01

    Manganese ferrite (MnFe2O4) nanoparticles of identical size (9 nm) and with different inversion degrees were synthesized under solvothermal conditions as a candidate theranostic system. In this facile approach, a long-chain amine, oleylamine, was utilized as a reducing and surface-functionalizing agent. The synthesized nanoparticles were shown to have a cubic-spinel structure as characterized by TEM and XRD patterns. Control over their inversion degree was achieved by a simple change of manganese precursor from Mn(acac)2 to Mn(acac)3. The variation in the inversion degree is ascribed to the partial oxidation of Mn(2+) to Mn(3+), as was evidenced by X-ray absorption near edge structure spectroscopy and extended X-ray absorption fine structure spectroscopy at both the Fe and Mn K-edges. The reduction of the inversion degree from 0.42 to 0.22 is close to the corresponding bulk value of 0.20 and led to elevated magnetization (65.7 emu g(-1)), in contrast to the Néel temperature, which was decreased owing to the weaker superexchange interactions between the tetrahedral and octahedral sites within the spinel structure. In order to evaluate the performance of these nanoprobes as a possible bifunctional targeting system, the (1)H NMR relaxation of the samples was tested together with their specific loss power under an alternating magnetic field as a function of concentration. The hydrophobic as prepared MnFe2O4 nanoparticles converted to hydrophilic nanoparticles with cetyltrimethylammonium bromide (CTAB). The MnFe2O4 nanoparticles, well-dispersed in aqueous media, were shown to have r2 relaxivity of up to 345.5 mM(-1) s(-1) and heat release of up to 286 W g(-1), demonstrating their potential use for bioapplications. PMID:25014470

  17. High-field 1H T1 and T2 NMR relaxation time measurements of H2O in homeopathic preparations of quartz, sulfur, and copper sulfate

    NASA Astrophysics Data System (ADS)

    Baumgartner, Stephan; Wolf, Martin; Skrabal, Peter; Bangerter, Felix; Heusser, Peter; Thurneysen, André; Wolf, Ursula

    2009-09-01

    Quantitative meta-analyses of randomized clinical trials investigating the specific therapeutic efficacy of homeopathic remedies yielded statistically significant differences compared to placebo. Since the remedies used contained mostly only very low concentrations of pharmacologically active compounds, these effects cannot be accounted for within the framework of current pharmacology. Theories to explain clinical effects of homeopathic remedies are partially based upon changes in diluent structure. To investigate the latter, we measured for the first time high-field (600/500 MHz) 1H T1 and T2 nuclear magnetic resonance relaxation times of H2O in homeopathic preparations with concurrent contamination control by inductively coupled plasma mass spectrometry (ICP-MS). Homeopathic preparations of quartz (10 c-30 c, n = 21, corresponding to iterative dilutions of 100-10-100-30), sulfur (13 x-30 x, n = 18, 10-13-10-30), and copper sulfate (11 c-30 c, n = 20, 100-11-100-30) were compared to n = 10 independent controls each (analogously agitated dilution medium) in randomized and blinded experiments. In none of the samples, the concentration of any element analyzed by ICP-MS exceeded 10 ppb. In the first measurement series (600 MHz), there was a significant increase in T1 for all samples as a function of time, and there were no significant differences between homeopathic potencies and controls. In the second measurement series (500 MHz) 1 year after preparation, we observed statistically significant increased T1 relaxation times for homeopathic sulfur preparations compared to controls. Fifteen out of 18 correlations between sample triplicates were higher for controls than for homeopathic preparations. No conclusive explanation for these phenomena can be given at present. Possible hypotheses involve differential leaching from the measurement vessel walls or a change in water molecule dynamics, i.e., in rotational correlation time and/or diffusion. Homeopathic preparations

  18. Two 1H-nuclear magnetic resonance methods to measure internal porosity of bone trabeculae: By solid-liquid signal separation and by longitudinal relaxation

    NASA Astrophysics Data System (ADS)

    Fantazzini, Paola; Bortolotti, Villiam; Brown, Robert J. S.; Camaiti, Mara; Garavaglia, Carla; Viola, Rossella; Giavaresi, Gianluca

    2004-01-01

    Parameters related to pore-space structure of the trabeculae in cancellous bone are difficult to determine quantitatively, but they can be important to characterize changes induced in bone by diseases such as osteoporosis. We present two nuclear magnetic resonance (NMR) methods to measure the internal porosity φtrab of the trabeculae, based on two different measurements of the fraction of intratrabecular and intertrabecular pore-space in animal femur samples. These procedures have been developed within the more general framework of the NMR studies for fluids in porous media. In the first method we use the ratio between the amount of collagen (solid-like) 1H and that of the fluids in the samples. In the second, which can be applied only on defatted and water saturated samples, we use the distributions of longitudinal relaxation times. The φtrab values obtained are constant for porosity φ of the samples over the range 40%-70%, with each method giving φtrab=(29±4)%, which is consistent with the only data available, the porosity of related cortical bone. The traditional parameter bone volume fraction is simply given by (1-φ)/(1-φtrab).

  19. Dynamics of [C{sub 3}H{sub 5}N{sub 2}]{sub 6}[Bi{sub 4}Br{sub 18}] by means of {sup 1}H NMR relaxometry and quadrupole relaxation enhancement

    SciTech Connect

    Masierak, W.; Florek-Wojciechowska, M.; Oglodek, I.; Jakubas, R.; Privalov, A. F.; Kresse, B.; Fujara, F.; Kruk, D.

    2015-05-28

    {sup 1}H spin-lattice field cycling relaxation dispersion experiments in the intermediate phase II of the solid [C{sub 3}H{sub 5}N{sub 2}]{sub 6}[Bi{sub 4}Br{sub 18}] are presented. Two motional processes have been identified from the {sup 1}H spin-lattice relaxation dispersion profiles and quantitatively described. It has been concluded that these processes are associated with anisotropic reorientations of the imidazolium ring, characterized by correlation times of the order of 10{sup −8} s-10{sup −9} s and of about 10{sup −5} s. Moreover, quadrupole relaxation enhancement (QRE) effects originating from slowly fluctuating {sup 1}H-{sup 14}N dipolar interactions have been observed. From the positions of the relaxation maxima, the quadrupole coupling parameters for the {sup 14}N nuclei in [C{sub 3}H{sub 5}N{sub 2}]{sub 6}[Bi{sub 4}Br{sub 18}] have been determined. The {sup 1}H-{sup 14}N relaxation contribution associated with the slow dynamics has been described in terms of a theory of QRE [Kruk et al., Solid State Nucl. Magn. Reson. 40, 114 (2011)] based on the stochastic Liouville equation. The shape of the QRE maxima (often referred to as “quadrupole peaks”) has been consistently reproduced for the correlation time describing the slow dynamics and the determined quadrupole coupling parameters.

  20. Magnetic relaxation induced by transverse flux shaking in MgB2 superconductors

    NASA Astrophysics Data System (ADS)

    Luzuriaga, J.; Badía-Majós, A.; Nieva, G.; Giordano, J. L.; López, C.; Serquis, A.; Serrano, G.

    2009-01-01

    We report on measurements and numerical simulations of the behavior of MgB2 superconductors when magnetic field components are applied along mutually perpendicular directions. By closely matching the geometry in simulations and measurements, full quantitative agreement is found. The critical state theory and a single phenomenological law, i.e. the field dependence of the critical current density Jc(B), are sufficient for a full quantitative description of the measurements. These were performed in thick strips of carbon nanotube doped MgB2 samples. Magnetization was measured in two orthogonal directions using a SQUID magnetometer. Magnetic relaxation effects induced by the application of an oscillatory perpendicular field were observed and simulated numerically. The measurements confirm the numerical predictions, that two relaxation regimes appear, depending on the amplitude of the applied magnetic field. The overall agreement constitutes a convincing validation of the critical state model and the numerical procedures used.

  1. Polarized Alkali-Metal Vapor with Minute-Long Transverse Spin-Relaxation Time

    NASA Astrophysics Data System (ADS)

    Balabas, M. V.; Karaulanov, T.; Ledbetter, M. P.; Budker, D.

    2010-08-01

    We demonstrate lifetimes of Zeeman populations and coherences in excess of 60 sec in alkali-metal vapor cells with inner walls coated with an alkene material. This represents 2 orders of magnitude improvement over the best paraffin coatings. We explore the temperature dependence of cells coated with this material and investigate spin-exchange relaxation-free magnetometry in a room-temperature environment, a regime previously inaccessible with conventional coating materials.

  2. Transverse relaxation of solvent protons induced by magnetized spheres: application to ferritin, erythrocytes, and magnetite

    SciTech Connect

    Gillis, P.; Koenig, S.H.

    1987-10-01

    Since 1/T2 of protons of tissue water is generally much greater than 1/T1 at typical imaging fields, small single-ion contrast agents--such as Gd(DTPA), which make comparable incremental contributions and therefore smaller fractional contributions to 1/T2 compared to 1/T1--are not as desirable for contrast-enhancement as agents that could enhance 1/T2 preferentially. In principle, such specialized agents will only be effective at higher fields because the field dependence (dispersion) of 1/T1 is such that it approaches zero at high fields whereas 1/T2 approaches a constant value. The residual 1/T2 is called the secular contribution and arises from fluctuations in time--as sensed by the protons of diffusing solvent or tissue water molecules--of the component of the magnetic field parallel to the static applied field. For solutions or suspensions of sufficiently large paramagnetic or ferromagnetic particles (greater than or equal to 250 A diameter), the paramagnetic contributions to the relaxation rates satisfy 1/T2 much greater than 1/T1 at typical imaging fields. We examine the theory of secular relaxation in some detail, particularly as it applies to systems relevant to magnetic resonance imaging, and then analyze the data for solutions, suspensions, or tissue containing ferritin, erythrocytes, agar-bound magnetite particles, and liver with low-density composite polymer-coated magnetite. In most cases we can explain the relaxation data, often quantitatively, in terms of the theory of relaxation of protons (water molecules) diffusing in the outer sphere environments of magnetized particles.

  3. Quantitative analysis of conformational exchange contributions to 1H-15N multiple-quantum relaxation using field-dependent measurements. Time scale and structural characterization of exchange in a calmodulin C-terminal domain mutant.

    PubMed

    Lundström, Patrik; Akke, Mikael

    2004-01-28

    Multiple-quantum spin relaxation is a sensitive probe for correlated conformational exchange dynamics on microsecond to millisecond time scales in biomolecules. We measured differential 1H-15N multiple-quantum relaxation rates for the backbone amide groups of the E140Q mutant of the C-terminal domain of calmodulin at three static magnetic field strengths. The differential multiple-quantum relaxation rates range between -88.7 and 92.7 s(-1), and the mean and standard deviation are 7.0 +/- 24 s(-1), at a static magnetic field strength of 14.1 T. Together with values of the 1H and 15N chemical shift anisotropies (CSA) determined separately, the field-dependent data enable separation of the different contributions from dipolar-dipolar, CSA-CSA, and conformational exchange cross-correlated relaxation mechanisms to the differential multiple-quantum relaxation rates. The procedure yields precise quantitative information on the dominant conformational exchange contributions observed in this protein. The field-dependent differences between double- and zero-quantum relaxation rates directly benchmark the rates of conformational exchange, showing that these are fast on the chemical shift time scale for the large majority of residues in the protein. Further analysis of the differential 1H-15N multiple-quantum relaxation rates using previously determined exchange rate constants and populations, obtained from 15N off-resonance rotating-frame relaxation data, enables extraction of the product of the chemical shift differences between the resonance frequencies of the 1H and 15N spins in the exchanging conformations, deltasigma(H)deltasigma(N). Thus, information on the 1H chemical shift differences is obtained, while circumventing complications associated with direct measurements of conformational exchange effects on 1H single-quantum coherences in nondeuterated proteins. The method significantly increases the information content available for structural interpretation of the

  4. NOTE: Detection limits for ferrimagnetic particle concentrations using magnetic resonance imaging based proton transverse relaxation rate measurements

    NASA Astrophysics Data System (ADS)

    Pardoe, H.; Chua-anusorn, W.; St. Pierre, T. G.; Dobson, J.

    2003-03-01

    A clinical magnetic resonance imaging (MRI) system was used to measure proton transverse relaxation rates (R2) in agar gels with varying concentrations of ferrimagnetic iron oxide nanoparticles in a field strength of 1.5 T. The nanoparticles were prepared by coprecipitation of ferric and ferrous ions in the presence of either dextran or polyvinyl alcohol. The method of preparation resulted in loosely packed clusters (dextran) or branched chains (polyvinyl alcohol) of particles containing of the order of 600 and 400 particles, respectively. For both methods of particle preparation, concentrations of ferrimagnetic iron in agar gel less than 0.01 mg ml-1 had no measurable effect on the value of R2 for the gel. The results indicate that MRI-based R2 measurements using 1.5 T clinical scanners are not quite sensitive enough to detect the very low concentrations of nanoparticulate biogenic magnetite reported in human brain tissue.

  5. Ultrafast direct modulation of transverse-mode coupled-cavity VCSELs far beyond the relaxation oscillation frequency

    NASA Astrophysics Data System (ADS)

    Dalir, Hamed; Koyama, Fumio

    2014-02-01

    A novel approach for bandwidth augmentation for direct modulation of VCSELs using transverse-coupled-cavity (TCC) scheme is raised, which enables us to tailor the modulation-transfer function. The base structure is similar to that of 3QW VCSELs with 980 nm wavelength operation. While the bandwidth of conventional VCSELs was limited by 9-10 GHz, the 3-dB bandwidth of TCC VCSEL with aperture diameters of 8.5×8.5μm2 and 3×3μm2 are increased by a factor of 3 far beyond the relaxation-oscillation frequency. Our current bandwidth achievement on the larger aperture size is 29 GHz which is limited by the used photo-detector. To the best of our knowledge this is the fastest 980 nm VCSEL.

  6. sup 31 P and sup 1 H NMR studies of the structure of enzyme-bound substrate complexes of lobster muscle arginine kinase: Relaxation measurements with Mn(II) and Co(II)

    SciTech Connect

    Jarori, G.K.; Ray, B.D.; Rao, B.D.N. )

    1989-11-28

    The paramagnetic effects of Mn(II) and Co(II) on the spin-lattice relaxation rates of {sup 31}P nuclei of ATP and ADP and of Mn(II) on the spin-lattice relaxation rate of the {delta} protons of arginine bound to arginine kinase from lobster tail muscle have been measured. Temperature variation of {sup 31}P relaxation rates in E-MnADP and E-MnATP yields activation energies ({Delta}E) in the range 6-10 kcal/mol. Thus, the {sup 31}P relaxation rates in these complexes are exchange limited and cannot provide structural information. However, the relaxation rates in E-CoADP and E-CoATP exhibit frequency dependence and {Delta}E values in the range 1-2 kcal/mol; i.e., these rates depend upon {sup 31}P-Co(II) distances. These distances were calculated to be in the range 3.2-4.5 {angstrom}, appropriate for direct coordination between Co(II) and the phosphoryl groups. The paramagnetic effect of Mn(II) on the {sup 1}H spin-lattice relaxation rate of the {delta} protons of arginine in the E-MnADP-Arg complex was also measured at three frequencies. From the frequency dependence of the relaxation rate an effective {tau}{sub C} of 0.6 ns has also been calculated, which is most likely to be the electron spin relaxation rate ({tau}{sub S1}) for Mn(II) in this complex. The distance estimated on the basis of the reciprocal sixth root of the average relaxation rate of the {delta} protons was 10.9 {plus minus} 0.3 {angstrom}.

  7. A theoretical study of rotational diffusion models for rod-shaped viruses. The influence of motion on 31P nuclear magnetic resonance lineshapes and transversal relaxation.

    PubMed Central

    Magusin, P C; Hemminga, M A

    1993-01-01

    Information about the interaction between nucleic acids and coat proteins in intact virus particles may be obtained by studying the restricted backbone dynamics of the incapsulated nucleic acids using 31P nuclear magnetic resonance (NMR) spectroscopy. In this article, simulations are carried out to investigate how reorientation of a rod-shaped virus particle as a whole and isolated nucleic acid motions within the virion influence the 31P NMR lineshape and transversal relaxation dominated by the phosphorus chemical shift anisotropy. Two opposite cases are considered on a theoretical level. First, isotropic rotational diffusion is used as a model for mobile nucleic acids that are loosely or partially bound to the protein coat. The effect of this type of diffusion on lineshape and transversal relaxation is calculated by solving the stochastic Liouville equation by an expansion in spherical functions. Next, uniaxial rotational diffusion is assumed to represent the mobility of phosphorus in a virion that rotates as a rigid rod about its length axis. This type of diffusion is approximated by an exchange process among discrete sites. As turns out from these simulations, the amplitude and the frequency of the motion can only be unequivocally determined from experimental data by a combined analysis of the lineshape and the transversal relaxation. In the fast motional region both the isotropic and the uniaxial diffusion model predict the same transversal relaxation as the Redfield theory. For very slow motion, transversal relaxation resembles the nonexponential relaxation as observed for water molecules undergoing translational diffusion in a magnetic field gradient. In this frequency region T2e is inversely proportional to the cube root of the diffusion coefficient. In addition to the isotropic and uniaxial diffusion models, a third model is presented, in which fast restricted nucleic acid backbone motions dominating the lineshape are superimposed on a slow rotation of the

  8. Assessment of tissue repair in full thickness chondral defects in the rabbit using magnetic resonance imaging transverse relaxation measurements.

    PubMed

    Ramaswamy, Sharan; Gurkan, Ilksen; Sharma, Blanka; Cascio, Brett; Fishbein, Kenneth W; Spencer, Richard G

    2008-08-01

    The purpose of this study was to determine if the noninvasive and nondestructive technique of magnetic resonance imaging could be used to quantify the amount of repair tissue that fills surgically-induced chondral defects in the rabbit. Sixteen 4-mm diameter full-thickness chondral defects were created. A photopolymerizable hydrogel was used to seal the defects as a treatment modality. At 5 weeks, the animals were sacrificed and the distal femur was subjected to MRI analyses at high field (9.4 T). The transverse relaxation time (T(2)) in each defect was measured. Histology and histomorphometric analysis were used to quantify the amount of repair tissue that filled each defect. The relationship between T(2) and percent tissue fill was found to fit well to a negatively sloped, linear model. The linear (Pearson's product-moment) correlation coefficient was found to be r = -0.82 and the associated coefficient of determination was r(2) = 0.67. This correlation suggests that the MRI parameter T(2) can be used to track changes in the amount of repair tissue that fills cartilage defects. This would be especially useful in in vivo cartilage tissue engineering studies that attempt to determine optimal biomaterials for scaffold design.

  9. Transverse spin relaxation and diffusion-constant measurements of spin-polarized 129Xe nuclei in the presence of a magnetic field gradient

    PubMed Central

    Liu, Xiaohu; Chen, Chang; Qu, Tianliang; Yang, Kaiyong; Luo, Hui

    2016-01-01

    The presence of a magnetic field gradient in a sample cell containing spin-polarized 129Xe atoms will cause an increased relaxation rate. We measured the transverse spin relaxation time of 129Xe verse the applied magnetic field gradient and the cell temperature. We then compared the different transverse spin relaxation behavior of dual isotopes of xenon (129Xe and 131Xe) due to magnetic field gradient in the same cell. The experiment results show the residual magnetic field gradient can be measured and compensated by applying a negative magnetic gradient in the sample cell. The transverse spin relaxation time of 129Xe could be increased 2–7 times longer when applying an appropriate magnetic field gradient. The experiment results can also be used to determine the diffusion constant of 129Xe in H2 and N2 to be 0.4 ± 0.26 cm2/sec and 0.12 ± 0.02 cm2/sec. The results are close with theoretical calculation. PMID:27049237

  10. Transverse spin relaxation and diffusion-constant measurements of spin-polarized 129Xe nuclei in the presence of a magnetic field gradient.

    PubMed

    Liu, Xiaohu; Chen, Chang; Qu, Tianliang; Yang, Kaiyong; Luo, Hui

    2016-01-01

    The presence of a magnetic field gradient in a sample cell containing spin-polarized (129)Xe atoms will cause an increased relaxation rate. We measured the transverse spin relaxation time of (129)Xe verse the applied magnetic field gradient and the cell temperature. We then compared the different transverse spin relaxation behavior of dual isotopes of xenon ((129)Xe and (131)Xe) due to magnetic field gradient in the same cell. The experiment results show the residual magnetic field gradient can be measured and compensated by applying a negative magnetic gradient in the sample cell. The transverse spin relaxation time of (129)Xe could be increased 2-7 times longer when applying an appropriate magnetic field gradient. The experiment results can also be used to determine the diffusion constant of (129)Xe in H2 and N2 to be 0.4 ± 0.26 cm(2)/sec and 0.12 ± 0.02 cm(2)/sec. The results are close with theoretical calculation. PMID:27049237

  11. Theoretical reason for the lack of influence of 1H-14N cross-relaxation on the water proton T 1 NMRD profile in slow tumbling proteins

    NASA Astrophysics Data System (ADS)

    Westlund, P.-O.

    2012-09-01

    For immobilized protein the water proton T 1-NMRD profile displays three enhanced relaxation peaks (QP). For slow tumbling proteins these relaxation peaks are not experimentally observed. However, the theoretically determined QP effect on the amide proton T 1-NMRD profile displays a distorted Lorentzian dispersion profile. The question arises as to whether there is also a distortion of the water-proton T 1-NMRD profile due to QP. The model of Sunde and Halle [J. Magn. Reson. 203, 257 (2010)] predicts a decreasing QP relaxation contribution and, with the aid of a model for tumbling proteins [P.-O. Westlund, Phys. Chem. Chem. Phys, 12, 3136 (2010)], it is shown that the QP effect is absent in water-proton T 1-NMRD profiles for slow tumbling proteins with τR < 1 µs, τI.

  12. 4 T actively detunable transmit/receive transverse electromagnetic coil and 4-channel receive-only phased array for (1)H human brain studies.

    PubMed

    Avdievich, Nikolai I; Hetherington, Hoby P

    2004-12-01

    The design and construction of a 4 T transverse electromagnetic (TEM) transmit/receive head coil and a four-channel phased array receive-only RF system are described. To enable both high-resolution imaging of the entire brain and high-resolution spectroscopic imaging, active PIN diode decoupling was used in both the TEM resonator and each surface coil in the array. This configuration allows for both transmission and reception from the volume coil as well as reception from the phased array. The surface coils were decoupled by overlapping the coils and using preamplifier decoupling. Since at high frequencies construction of a lumped element matching quarter wavelength transformer, an important component of the preamplifier decoupling, becomes difficult, a transmission line approach was used. The system was tested and compared to a TEM volume transmit/receive head coil. A four- to sixfold improvement in signal-to-noise ratio from the sensitive volume of the array was achieved.

  13. 4 T actively detunable transmit/receive transverse electromagnetic coil and 4-channel receive-only phased array for (1)H human brain studies.

    PubMed

    Avdievich, Nikolai I; Hetherington, Hoby P

    2004-12-01

    The design and construction of a 4 T transverse electromagnetic (TEM) transmit/receive head coil and a four-channel phased array receive-only RF system are described. To enable both high-resolution imaging of the entire brain and high-resolution spectroscopic imaging, active PIN diode decoupling was used in both the TEM resonator and each surface coil in the array. This configuration allows for both transmission and reception from the volume coil as well as reception from the phased array. The surface coils were decoupled by overlapping the coils and using preamplifier decoupling. Since at high frequencies construction of a lumped element matching quarter wavelength transformer, an important component of the preamplifier decoupling, becomes difficult, a transmission line approach was used. The system was tested and compared to a TEM volume transmit/receive head coil. A four- to sixfold improvement in signal-to-noise ratio from the sensitive volume of the array was achieved. PMID:15562466

  14. Effects of Mesoporous Silica Coating and Post-Synthetic Treatment on the Transverse Relaxivity of Iron Oxide Nanoparticles

    PubMed Central

    Hurley, Katie R.; Lin, Yu-Shen; Zhang, Jinjin; Egger, Sam M.; Haynes, Christy L.

    2013-01-01

    Mesoporous silica nanoparticles have the capacity to load and deliver therapeutic cargo and incorporate imaging modalities, making them prominent candidates for theranostic devices. One of the most widespread imaging agents utilized in this and other theranostic platforms is nanoscale superparamagnetic iron oxide. Although several core-shell magnetic mesoporous silica nanoparticles presented in the literature have provided high T2 contrast in vitro and in vivo, there is ambiguity surrounding which parameters lead to enhanced contrast. Additionally, there is a need to understand the behavior of these imaging agents over time in biologically relevant environments. Herein, we present a systematic analysis of how the transverse relaxivity (r2) of magnetic mesoporous silica nanoparticles is influenced by nanoparticle diameter, iron oxide nanoparticle core synthesis, and the use of a hydrothermal treatment. This work demonstrates that samples which did not undergo a hydrothermal treatment experienced a drop in r2 (75% of original r2 within 8 days of water storage), while samples with hydrothermal treatment maintained roughly the same r2 for over 30 days in water. Our results suggest that iron oxide oxidation is the cause of the r2 loss, and this oxidation can be prevented both during synthesis and storage by the use of deoxygenated conditions during nanoparticle synthesis. The hydrothermal treatment also provides colloidal stability, even in acidic and highly salted solutions, and a resistance against acid degradation of the iron oxide nanoparticle core. The results of this study show the promise of multifunctional mesoporous silica nanoparticles but will also likely inspire further investigation into multiples types of theranostic devices, taking into consideration their behavior over time and in relevant biological environments. PMID:23814377

  15. (1)H and (19)F spin-lattice relaxation and CH3 or CF3 reorientation in molecular solids containing both H and F atoms.

    PubMed

    Beckmann, Peter A; Rheingold, Arnold L

    2016-04-21

    The dynamics of methyl (CH3) and fluoromethyl (CF3) groups in organic molecular (van der Waals) solids can be exploited to survey their local environments. We report solid state (1)H and (19)F spin-lattice relaxationexperiments in polycrystalline 3-trifluoromethoxycinnamic acid, along with an X-ray diffraction determination of the molecular and crystal structure, to investigate the intramolecular and intermolecular interactions that determine the properties that characterize the CF3 reorientation. The molecule is of no particular interest; it simply provides a motionless backbone (on the nuclear magnetic resonance(NMR) time scale) to investigate CF3 reorientation occurring on the NMR time scale. The effects of (19)F-(19)F and (19)F-(1)H spin-spin dipolar interactions on the complicated nonexponential NMRrelaxation provide independent inputs into determining a model for CF3 reorientation. As such, these experiments provide much more information than when only one spin species (usually (1)H) is present. In Sec. IV, which can be read immediately after the Introduction without reading the rest of the paper, we compare the barrier to CH3 and CF3 reorientation in seven organic solids and separate this barrier into intramolecular and intermolecular components. PMID:27389221

  16. (1)H and (19)F spin-lattice relaxation and CH3 or CF3 reorientation in molecular solids containing both H and F atoms.

    PubMed

    Beckmann, Peter A; Rheingold, Arnold L

    2016-04-21

    The dynamics of methyl (CH3) and fluoromethyl (CF3) groups in organic molecular (van der Waals) solids can be exploited to survey their local environments. We report solid state (1)H and (19)F spin-lattice relaxationexperiments in polycrystalline 3-trifluoromethoxycinnamic acid, along with an X-ray diffraction determination of the molecular and crystal structure, to investigate the intramolecular and intermolecular interactions that determine the properties that characterize the CF3 reorientation. The molecule is of no particular interest; it simply provides a motionless backbone (on the nuclear magnetic resonance(NMR) time scale) to investigate CF3 reorientation occurring on the NMR time scale. The effects of (19)F-(19)F and (19)F-(1)H spin-spin dipolar interactions on the complicated nonexponential NMRrelaxation provide independent inputs into determining a model for CF3 reorientation. As such, these experiments provide much more information than when only one spin species (usually (1)H) is present. In Sec. IV, which can be read immediately after the Introduction without reading the rest of the paper, we compare the barrier to CH3 and CF3 reorientation in seven organic solids and separate this barrier into intramolecular and intermolecular components.

  17. Effects of in-pulse transverse relaxation in 3D ultrashort echo time sequences: Analytical derivation, comparison to numerical simulation and experimental application at 3 T

    NASA Astrophysics Data System (ADS)

    Springer, Fabian; Steidle, Günter; Martirosian, Petros; Claussen, Claus D.; Schick, Fritz

    2010-09-01

    The introduction of ultrashort-echo-time-(UTE)-sequences to clinical whole-body MR scanners has opened up the field of MR characterization of materials or tissues with extremely fast signal decay. If the transverse relaxation time is in the range of the RF-pulse duration, approximation of the RF-pulse by an instantaneous rotation applied at the middle of the RF-pulse and immediately followed by free relaxation will lead to a distinctly underestimated echo signal. Thus, the regular Ernst equation is not adequate to correctly describe steady state signal under those conditions. The paper presents an analytically derived modified Ernst equation, which correctly describes in-pulse relaxation of transverse magnetization under typical conditions: The equation is valid for rectangular excitation pulses, usually applied in 3D UTE sequences. Longitudinal relaxation time of the specimen must be clearly longer than RF-pulse duration, which is fulfilled for tendons and bony structures as well as many solid materials. Under these conditions, the proposed modified Ernst equation enables adequate and relatively simple calculation of the magnetization of materials or tissues. Analytically derived data are compared to numerical results obtained by using an established Runge-Kutta-algorithm based on the Bloch equations. Validity of the new approach was also tested by systematical measurements of a solid polymeric material on a 3 T whole-body MR scanner. Thus, the presented modified Ernst equation provides a suitable basis for T1 measurements, even in tissues with T2 values as short as the RF-pulse duration: independent of RF-pulse duration, the 'variable flip angle method' led to consistent results of longitudinal relaxation time T1, if the T2 relaxation time of the material of interest is known as well.

  18. Solid state {sup 1}H spin-lattice relaxation and isolated-molecule and cluster electronic structure calculations in organic molecular solids: The relationship between structure and methyl group and t-butyl group rotation

    SciTech Connect

    Wang, Xianlong E-mail: pbeckman@brynmawr.edu; Mallory, Frank B.; Mallory, Clelia W.; Odhner, Hosanna R.; Beckmann, Peter A. E-mail: pbeckman@brynmawr.edu

    2014-05-21

    We report ab initio density functional theory electronic structure calculations of rotational barriers for t-butyl groups and their constituent methyl groups both in the isolated molecules and in central molecules in clusters built from the X-ray structure in four t-butyl aromatic compounds. The X-ray structures have been reported previously. We also report and interpret the temperature dependence of the solid state {sup 1}H nuclear magnetic resonance spin-lattice relaxation rate at 8.50, 22.5, and 53.0 MHz in one of the four compounds. Such experiments for the other three have been reported previously. We compare the computed barriers for methyl group and t-butyl group rotation in a central target molecule in the cluster with the activation energies determined from fitting the {sup 1}H NMR spin-lattice relaxation data. We formulate a dynamical model for the superposition of t-butyl group rotation and the rotation of the t-butyl group's constituent methyl groups. The four compounds are 2,7-di-t-butylpyrene, 1,4-di-t-butylbenzene, 2,6-di-t-butylnaphthalene, and 3-t-butylchrysene. We comment on the unusual ground state orientation of the t-butyl groups in the crystal of the pyrene and we comment on the unusually high rotational barrier of these t-butyl groups.

  19. Incorporating reversible and irreversible transverse relaxation effects into Steady State Free Precession (SSFP) signal intensity expressions for fMRI considerations.

    PubMed

    Mulkern, Robert V; Balasubramanian, Mukund; Orbach, Darren B; Mitsouras, Dimitrios; Haker, Steven J

    2013-04-01

    Among the multiple sequences available for functional magnetic resonance imaging (fMRI), the Steady State Free Precession (SSFP) sequence offers the highest signal-to-noise ratio (SNR) per unit time as well as distortion free images not feasible with the more commonly employed single-shot echo planar imaging (EPI) approaches. Signal changes occurring with activation in SSFP sequences reflect underlying changes in both irreversible and reversible transverse relaxation processes. The latter are characterized by changes in the central frequencies and widths of the inherent frequency distribution present within a voxel. In this work, the well-known frequency response of the SSFP signal intensity is generalized to include the widths and central frequencies of some common frequency distributions on SSFP signal intensities. The approach, using a previously unnoted series expansion, allows for a separation of reversible from irreversible transverse relaxation effects on SSFP signal intensity changes. The formalism described here should prove useful for identifying and modeling mechanisms associated with SSFP signal changes accompanying neural activation.

  20. Incorporating reversible and irreversible transverse relaxation effects into Steady State Free Precession (SSFP) signal intensity expressions for fMRI considerations.

    PubMed

    Mulkern, Robert V; Balasubramanian, Mukund; Orbach, Darren B; Mitsouras, Dimitrios; Haker, Steven J

    2013-04-01

    Among the multiple sequences available for functional magnetic resonance imaging (fMRI), the Steady State Free Precession (SSFP) sequence offers the highest signal-to-noise ratio (SNR) per unit time as well as distortion free images not feasible with the more commonly employed single-shot echo planar imaging (EPI) approaches. Signal changes occurring with activation in SSFP sequences reflect underlying changes in both irreversible and reversible transverse relaxation processes. The latter are characterized by changes in the central frequencies and widths of the inherent frequency distribution present within a voxel. In this work, the well-known frequency response of the SSFP signal intensity is generalized to include the widths and central frequencies of some common frequency distributions on SSFP signal intensities. The approach, using a previously unnoted series expansion, allows for a separation of reversible from irreversible transverse relaxation effects on SSFP signal intensity changes. The formalism described here should prove useful for identifying and modeling mechanisms associated with SSFP signal changes accompanying neural activation. PMID:23337079

  1. Rapid monitoring of iron-chelating therapy in thalassemia major by a new cardiovascular MR measure: the reduced transverse relaxation rate.

    PubMed

    Kim, Daniel; Jensen, Jens H; Wu, Ed X; Feng, Li; Au, Wing-Yan; Cheung, Jerry S; Ha, Shau-Yin; Sheth, Sujit S; Brittenham, Gary M

    2011-08-01

    In iron overload, almost all the excess iron is stored intracellularly as rapidly mobilizable ferritin iron and slowly exchangeable hemosiderin iron. Increases in cytosolic iron may produce oxidative damage that ultimately results in cardiomyocyte dysfunction. Because intracellular ferritin iron is evidently in equilibrium with the low-molecular-weight cytosolic iron pool, measurements of ferritin iron potentially provide a clinically useful indicator of changes in cytosolic iron. The cardiovascular magnetic resonance (CMR) index of cardiac iron used clinically, the effective transverse relaxation rate (R(2)*), is principally influenced by hemosiderin iron and changes only slowly over several months, even with intensive iron-chelating therapy. Another conventional CMR index of cardiac iron, the transverse relaxation rate (R(2)), is sensitive to both hemosiderin iron and ferritin iron. We have developed a new MRI measure, the 'reduced transverse relaxation rate' (RR(2)), and have proposed in previous studies that this measure is primarily sensitive to ferritin iron and largely independent of hemosiderin iron in phantoms mimicking ferritin iron and human liver explants. We hypothesized that RR(2) could detect changes produced by 1 week of iron-chelating therapy in patients with transfusion-dependent thalassemia. We imaged 10 patients with thalassemia major at 1.5 T in mid-ventricular short-axis planes of the heart, initially after suspending iron-chelating therapy for 1 week and subsequently after resuming oral deferasirox. After resuming iron-chelating therapy, significant decreases were observed in the mean myocardial RR(2) (7.8%, p < 0.01) and R(2) (5.5%, p < 0.05), but not in R(2)* (1.7%, p > 0.90). Although the difference between changes in RR(2) and R(2) was not significant (p > 0.3), RR(2) was consistently more sensitive than R(2) (and R(2)*) to the resumption of iron-chelating therapy, as judged by the effect sizes of relaxation rate differences detected

  2. Development of qualitative and quantitative analysis methods in pharmaceutical application with new selective signal excitation methods for 13 C solid-state nuclear magnetic resonance using 1 H T1rho relaxation time.

    PubMed

    Nasu, Mamiko; Nemoto, Takayuki; Mimura, Hisashi; Sako, Kazuhiro

    2013-01-01

    Most pharmaceutical drug substances and excipients in formulations exist in a crystalline or amorphous form, and an understanding of their state during manufacture and storage is critically important, particularly in formulated products. Carbon 13 solid-state nuclear magnetic resonance (NMR) spectroscopy is useful for studying the chemical and physical state of pharmaceutical solids in a formulated product. We developed two new selective signal excitation methods in (13) C solid-state NMR to extract the spectrum of a target component from such a mixture. These methods were based on equalization of the proton relaxation time in a single domain via rapid intraproton spin diffusion and the difference in proton spin-lattice relaxation time in the rotating frame ((1) H T1rho) of individual components in the mixture. Introduction of simple pulse sequences to one-dimensional experiments reduced data acquisition time and increased flexibility. We then demonstrated these methods in a commercially available drug and in a mixture of two saccharides, in which the (13) C signals of the target components were selectively excited, and showed them to be applicable to the quantitative analysis of individual components in solid mixtures, such as formulated products, polymorphic mixtures, or mixtures of crystalline and amorphous phases. PMID:23147444

  3. Graphene oxide-Fe{sub 3}O{sub 4} nanoparticle composite with high transverse proton relaxivity value for magnetic resonance imaging

    SciTech Connect

    Venkatesha, N.; Srivastava, Chandan; Poojar, Pavan; Geethanath, Sairam; Qurishi, Yasrib

    2015-04-21

    The potential of graphene oxide–Fe{sub 3}O{sub 4} nanoparticle (GO-Fe{sub 3}O{sub 4}) composite as an image contrast enhancing material in magnetic resonance imaging has been investigated. Proton relaxivity values were obtained in three different homogeneous dispersions of GO-Fe{sub 3}O{sub 4} composites synthesized by precipitating Fe{sub 3}O{sub 4} nanoparticles in three different reaction mixtures containing 0.01 g, 0.1 g, and 0.2 g of graphene oxide. A noticeable difference in proton relaxivity values was observed between the three cases. A comprehensive structural and magnetic characterization revealed discrete differences in the extent of reduction of the graphene oxide and spacing between the graphene oxide sheets in the three composites. The GO-Fe{sub 3}O{sub 4} composite framework that contained graphene oxide with least extent of reduction of the carboxyl groups and largest spacing between the graphene oxide sheets provided the optimum structure for yielding a very high transverse proton relaxivity value. It was found that the GO-Fe{sub 3}O{sub 4} composites possessed good biocompatibility with normal cell lines, whereas they exhibited considerable toxicity towards breast cancer cells.

  4. The interaction between apparent diffusion coefficients and transverse relaxation rates of human brain metabolites and water studied by diffusion-weighted spectroscopy at 7 T.

    PubMed

    Branzoli, Francesca; Ercan, Ece; Webb, Andrew; Ronen, Itamar

    2014-05-01

    The dependence of apparent diffusion coefficients (ADCs) of molecules in biological tissues on an acquisition-specific timescale is a powerful mechanism for studying tissue microstructure. Unlike water, metabolites are confined mainly to intracellular compartments, thus providing higher specificity to tissue microstructure. Compartment-specific structural and chemical properties may also affect molecule transverse relaxation times (T₂). Here, we investigated the correlation between diffusion and relaxation for N-acetylaspartate, creatine and choline compounds in human brain white matter in vivo at 7 T, and compared them with those of water under the same experimental conditions. Data were acquired in a volume of interest in parietal white matter at two different diffusion times, Δ = 44 and 246 ms, using a matrix of three echo times (T(E)) and five diffusion weighting values (up to 4575 s/mm²). Significant differences in the dependence of the ADCs on T(E) were found between water and metabolites, as well as among the different metabolites. A significant decrease in water ADC as a function of TE was observed only at the longest diffusion time (p < 0.001), supporting the hypothesis that at least part of the restricted water pool can be associated with longer T₂, as suggested by previous studies in vitro. Metabolite data showed an increase of creatine (p < 0.05) and N-acetylaspartate (p < 0.05) ADCs with TE at Δ = 44 ms, and a decrease of creatine (p < 0.05) and N-acetylaspartate (p = 0.1) ADCs with TE at Δ = 246 ms. No dependence of choline ADC on TE was observed. The metabolite results suggest that diffusion and relaxation properties are dictated not only by metabolite distribution in different cell types, but also by other mechanisms, such as interactions with membranes, exchange between "free" and "bound" states or interactions with microsusceptibility gradients.

  5. Spin-echo methods for the determination of 31P transverse relaxation times of the ATP NMR signals in vivo.

    PubMed

    Straubinger, K; Jung, W I; Bunse, M; Lutz, O; Küper, K; Dietze, G

    1994-01-01

    31P magnetic resonance spectroscopy (MRS) examinations of the calf muscles of healthy volunteers were performed to determine T2 of the coupled ATP signals by use of the Hahn spin-echo and the frequency-selective spin-echo method. Additional measurements with the J-coupling refocused double echo are presented. The most reliable determination of T2 relaxation times is possible with the frequency-selective spin echo. The other methods yield substantially wrong results. Theoretical explanations are given how J-coupling and pulse-angle deviations affect the signals and therefore the T2 determinations. The calculations for a weakly coupled homonuclear AX spin system are shown because they demonstrate most of the relevant facts. In addition, some important results for a homonuclear AMX spin system, which the ATP is considered to be, are given.

  6. Prognostic Significance of Transverse Relaxation Rate (R2*) in Blood Oxygenation Level-Dependent Magnetic Resonance Imaging in Patients with Invasive Breast Cancer

    PubMed Central

    Choi, Hye Young; Ko, Eun Sook; Han, Boo-Kyung; Kim, Eun Ju; Kim, Sun Mi; Lim, Yaeji; Kim, Rock Bum

    2016-01-01

    Objective To examine the relationship between magnetic resonance transverse relaxation rate (R2*) and prognostic factors. Materials and Methods A total of 159 women with invasive ductal carcinomas (IDCs) underwent breast magnetic resonance imaging (MRI) including blood oxygenation level-dependent (BOLD) sequence at 3 T. The distribution of the measured R2* values were analyzed, and the correlation between R2* and various prognostic factors (age, tumor size, histologic grade, lymphovascular invasion, and axillary lymph node status, as well as expression of estrogen receptor, progesterone receptor, human epidermal growth factor receptor 2, p53, and Ki-67) were retrospectively assessed using patient medical records. Results The baseline R2* values of the IDCs were very heterogeneous with wide range among the patients. The mean R2* value was (32.8 ± 14.0) Hz with a median of 29.3 Hz (range 13.5–109.4 Hz). In multivariate analysis, older age was associated with decreased R2* value (P = 0.011) and IDCs with p53-overexpression showed higher R2* values than those without p53-overexpression group (P = 0.031). Other prognostic factors were not significantly correlated with R2* value. Conclusion In this study, R2* values were significantly correlated with age and expression of p53. Further studies are necessary to determine the prognostic value of BOLD-MRI. PMID:27384310

  7. Lung Parenchymal Signal Intensity in MRI: A Technical Review with Educational Aspirations Regarding Reversible Versus Irreversible Transverse Relaxation Effects in Common Pulse Sequences.

    PubMed

    Mulkern, Robert; Haker, Steven; Mamata, Hatsuho; Lee, Edward; Mitsouras, Dimitrios; Oshio, Koichi; Balasubramanian, Mukund; Hatabu, Hiroto

    2014-03-01

    Lung parenchyma is challenging to image with proton MRI. The large air space results in ~l/5th as many signal-generating protons compared to other organs. Air/tissue magnetic susceptibility differences lead to strong magnetic field gradients throughout the lungs and to broad frequency distributions, much broader than within other organs. Such distributions have been the subject of experimental and theoretical analyses which may reveal aspects of lung microarchitecture useful for diagnosis. Their most immediate relevance to current imaging practice is to cause rapid signal decays, commonly discussed in terms of short T2 (*) values of 1 ms or lower at typical imaging field strengths. Herein we provide a brief review of previous studies describing and interpreting proton lung spectra. We then link these broad frequency distributions to rapid signal decays, though not necessarily the exponential decays generally used to define T2 (*) values. We examine how these decays influence observed signal intensities and spatial mapping features associated with the most prominent torso imaging sequences, including spoiled gradient and spin echo sequences. Effects of imperfect refocusing pulses on the multiple echo signal decays in single shot fast spin echo (SSFSE) sequences and effects of broad frequency distributions on balanced steady state free precession (bSSFP) sequence signal intensities are also provided. The theoretical analyses are based on the concept of explicitly separating the effects of reversible and irreversible transverse relaxation processes, thus providing a somewhat novel and more general framework from which to estimate lung signal intensity behavior in modern imaging practice. PMID:25228852

  8. Lung Parenchymal Signal Intensity in MRI: A Technical Review with Educational Aspirations Regarding Reversible Versus Irreversible Transverse Relaxation Effects in Common Pulse Sequences

    PubMed Central

    MULKERN, ROBERT; HAKER, STEVEN; MAMATA, HATSUHO; LEE, EDWARD; MITSOURAS, DIMITRIOS; OSHIO, KOICHI; BALASUBRAMANIAN, MUKUND; HATABU, HIROTO

    2014-01-01

    Lung parenchyma is challenging to image with proton MRI. The large air space results in ~l/5th as many signal-generating protons compared to other organs. Air/tissue magnetic susceptibility differences lead to strong magnetic field gradients throughout the lungs and to broad frequency distributions, much broader than within other organs. Such distributions have been the subject of experimental and theoretical analyses which may reveal aspects of lung microarchitecture useful for diagnosis. Their most immediate relevance to current imaging practice is to cause rapid signal decays, commonly discussed in terms of short T2* values of 1 ms or lower at typical imaging field strengths. Herein we provide a brief review of previous studies describing and interpreting proton lung spectra. We then link these broad frequency distributions to rapid signal decays, though not necessarily the exponential decays generally used to define T2* values. We examine how these decays influence observed signal intensities and spatial mapping features associated with the most prominent torso imaging sequences, including spoiled gradient and spin echo sequences. Effects of imperfect refocusing pulses on the multiple echo signal decays in single shot fast spin echo (SSFSE) sequences and effects of broad frequency distributions on balanced steady state free precession (bSSFP) sequence signal intensities are also provided. The theoretical analyses are based on the concept of explicitly separating the effects of reversible and irreversible transverse relaxation processes, thus providing a somewhat novel and more general framework from which to estimate lung signal intensity behavior in modern imaging practice. PMID:25228852

  9. Paramagnetic Inversion of the Sign of the Interference Contribution to the Transverse Relaxation of the Imido Protons of the Coordinated Imidazoles in the Uniformly 15N-Labeled Cytochrome c3

    NASA Astrophysics Data System (ADS)

    Ohmura, Tomoaki; Harada, Erisa; Fujiwara, Toshimichi; Kawai, Gota; Watanabe, Kimitsuna; Akutsu, Hideo

    1998-04-01

    In the spectrum of uniformly15N-labeled cytochromec3, the relative linewidths of the doublet peaks of the15N-coupled imido proton of the coordinated imidazole group were reversed on oxidation. This inversion was explained by the interference relaxation process between the electron-proton dipolar and15N-1H dipolar interactions. The inversion can be used to assign the imido protons of the coordinated imidazole groups in heme proteins.

  10. U1h Superstructure

    SciTech Connect

    Glen Sykes

    2000-11-01

    The U1H Shaft Project is a design build subcontract to supply the U. S. Department of Energy (DOE) a 1,045 ft. deep, 20 ft. diameter, concrete lined shaft for unspecified purposes. The subcontract awarded to Atkinson Construction by Bechtel Nevada to design and construct the shaft for the DOE has been split into phases with portions of the work being released as dictated by available funding. The first portion released included the design for the shaft, permanent hoist, headframe, and collar arrangement. The second release consisted of constructing the shaft collar to a depth of 110 ft., the service entry, utility trenches, and installation of the temporary sinking plant. The temporary sinking plant included the installation of the sinking headframe, the sinking hoist, two deck winches, the shaft form, the sinking work deck, and temporary utilities required to sink the shaft. Both the design and collar construction were completed on schedule. The third release consisted of excavating and lining the shaft to the station depth of approximately 950 feet. Work is currently proceeding on this production sinking phase. At a depth of approximately 600 feet, Atkinson has surpassed production expectation and is more than 3 months ahead of schedule. Atkinson has employed the use of a Bobcat 331 excavator as the primary means of excavation. the shaft is being excavated entirely in an alluvial deposit with varying degrees of calcium carbonate cementation. Several more work packages are expected to be released in the near future. The remaining work packages include, construction of the shaft station a depth of 975 ft. and construction of the shaft sump to a depth of 1,045 ft., installation of the loading pocket and station steel and equipment, installation of the shaft steel and guides, installation of the shaft utilities, and installation of the permanent headframe, hoist, collar utilities, and facilities.

  11. Spatially resolved solid-state 1H NMR for evaluation of gradient-composition polymeric libraries.

    PubMed

    Leisen, Johannes; Gomez, Ismael J; Roper, John A; Meredith, J Carson; Beckham, Haskell W

    2012-07-01

    Polyurethane libraries consisting of films with composition gradients of aliphatic polyisocyanate and hydroxy-terminated polyacrylate resin were characterized using methods of (1)H NMR microimaging (i.e., magnetic resonance imaging, (MRI)) and solid-state NMR. Molecular mobilities and underlying structural information were extracted as a function of the relative content of each of the two components. Routine NMR microimaging using the spin-echo sequence only allows investigations of transverse relaxation of magnetization at echo times >2 ms. A single-exponential decay was found, which is likely due to free, noncross-linked polymer chains. The mobility of these chains decreases with increasing content of the aliphatic polyisocyanate. The concept of a 1D NMR profiler is introduced as a novel modality for library screening, which allows the convenient measurement of static solid-state NMR spectra as a function of spatial location along a library sample that is repositioned in the rf coil between experiments. With this setup the complete transverse relaxation function was measured using Bloch decays and spin echoes. For all positions within the gradient-composition film, relaxation data consisted of at least three components that were attributed to a rigid highly cross-linked resin, an intermediate cross-linked but mobile constituent, and the highly mobile free polymer chains (the latter is also detectable by MRI). Analysis of this overall relaxation function measured via Bloch decays and spin echoes revealed only minor changes in the mobilities of the individual fractions. Findings with respect to the most mobile components are consistent with the results obtained by NMR microimaging. The major effect is the significant increase in the rigid-component fraction with the addition of the hydroxy-terminated polyacrylate resin. PMID:22676634

  12. Rapid measurement of multidimensional 1H solid-state NMR spectra at ultra-fast MAS frequencies

    NASA Astrophysics Data System (ADS)

    Ye, Yue Qi; Malon, Michal; Martineau, Charlotte; Taulelle, Francis; Nishiyama, Yusuke

    2014-02-01

    A novel method to realize rapid repetition of 1H NMR experiments at ultra-fast MAS frequencies is demonstrated. The ultra-fast MAS at 110 kHz slows the 1H-1H spin diffusion, leading to variations of 1H T1 relaxation times from atom to atom within a molecule. The different relaxation behavior is averaged by applying 1H-1H recoupling during relaxation delay even at ultra-fast MAS, reducing the optimal relaxation delay to maximize the signal to noise ratio. The way to determine optimal relaxation delay for arbitrary relaxation curve is shown. The reduction of optimal relaxation delay by radio-frequency driven recoupling (RFDR) was demonstrated on powder samples of glycine and ethenzamide with one and multi-dimensional NMR measurements.

  13. Following Metabolism in Living Microorganisms by Hyperpolarized (1)H NMR.

    PubMed

    Dzien, Piotr; Fages, Anne; Jona, Ghil; Brindle, Kevin M; Schwaiger, Markus; Frydman, Lucio

    2016-09-21

    Dissolution dynamic nuclear polarization (dDNP) is used to enhance the sensitivity of nuclear magnetic resonance (NMR), enabling monitoring of metabolism and specific enzymatic reactions in vivo. dDNP involves rapid sample dissolution and transfer to a spectrometer/scanner for subsequent signal detection. So far, most biologically oriented dDNP studies have relied on hyperpolarizing long-lived nuclear spin species such as (13)C in small molecules. While advantages could also arise from observing hyperpolarized (1)H, short relaxation times limit the utility of prepolarizing this sensitive but fast relaxing nucleus. Recently, it has been reported that (1)H NMR peaks in solution-phase experiments could be hyperpolarized by spontaneous magnetization transfers from bound (13)C nuclei following dDNP. This work demonstrates the potential of this sensitivity-enhancing approach to probe the enzymatic process that could not be suitably resolved by (13)C dDNP MR. Here we measured, in microorganisms, the action of pyruvate decarboxylase (PDC) and pyruvate formate lyase (PFL)-enzymes that catalyze the decarboxylation of pyruvate to form acetaldehyde and formate, respectively. While (13)C NMR did not possess the resolution to distinguish the starting pyruvate precursor from the carbonyl resonances in the resulting products, these processes could be monitored by (1)H NMR at 500 MHz. These observations were possible in both yeast and bacteria in minute-long kinetic measurements where the hyperpolarized (13)C enhanced, via (13)C → (1)H cross-relaxation, the signals of protons binding to the (13)C over the course of enzymatic reactions. In addition to these spontaneous heteronuclear enhancement experiments, single-shot acquisitions based on J-driven (13)C → (1)H polarization transfers were also carried out. These resulted in higher signal enhancements of the (1)H resonances but were not suitable for multishot kinetic studies. The potential of these (1)H-based approaches for

  14. Noninvasive monitoring of moisture uptake in Ca(NO3)2 -polluted calcareous stones by 1H-NMR relaxometry.

    PubMed

    Casieri, Cinzia; Terenzi, Camilla; De Luca, Francesco

    2015-01-01

    NMR transverse relaxation time (T(2)) distribution of (1)H nuclei of water has been used to monitor the moisture condensation kinetics in Ca(NO(3))(2)  · (4)H(2)O-polluted Lecce stone, a calcareous stone with highly regular porous structure often utilized as basic material in Baroque buildings. Polluted samples have been exposed to water vapor adsorption at controlled relative humidity to mimic environmental conditions. In presence of pollutants, the T(2) distributions of water in stone exhibit a range of relaxation time values and amplitudes not observed in the unpolluted case. These characteristics could be exploited for in situ noninvasive detection of salt pollution in Lecce stone or as damage precursors in architectural buildings of cultural heritage interest. PMID:25354389

  15. New structural information on a humic acid from two-dimensional 1H-13C correlation solid-state nuclear magnetic resonance.

    PubMed

    Mao, J D; Xing, B; Schmidt-Rohr, K

    2001-05-15

    New information on the chemical structure of a peat humic acid has been obtained using a series of two-dimensional 1H-13C heteronuclear correlation solid-state NMR (HETCOR) experiments with different contact times and with spectral editing by dipolar dephasing and 13C transverse relaxation filtering. Carbon-bonded methyl groups (C-CH3) are found to be near both aliphatic and O-alkyl but not aromatic groups. The spectra prove that most OCH3 groups are connected directly with the aromatic rings, as is typical in lignin. As a result, about one-third of the aromatic C-O groups is not phenolic C-OH but C-OCH3. Both protonated and unprotonated anomeric O-C-O carbons are identified in the one- and two-dimensional spectra. COO groups are found predominantly in OCHn-COO environments, but some are also bonded to aromatic rings and aliphatic groups. All models of humic acids in the literature lack at least some of the features observed here. Compositional heterogeneity was studied by introducing 1H spin diffusion into the HETCOR experiment. Comparison with data for a synthetic polymer, polycarbonate, indicates that the separation between O-alkyl and aromatic groups in the humic acid is less than 1.5 nm. However, transverse 13C relaxation filtering under 1H decoupling reveals heterogeneity on a nanometer scale, with the slow-relaxing component being rich in lignin-like aromatic-C-O-CH3 moieties and poor in COO groups.

  16. Dynamic 1H NMR Studies of Schiff Base Derivatives

    NASA Astrophysics Data System (ADS)

    Köylü, M. Z.; Ekinci, A.; Böyükata, M.; Temel, H.

    2016-01-01

    The spin-lattice relaxation time T 1 and the spin-spin relaxation time T 2 of two Schiff base derivatives, N,N'-ethylenebis(salicylidene)-1,2-diaminoethane (H2L1) and N,N'-ethylenebis (salicylidene)-1,3-diaminopropane (H2L2), in DMSO-d6 solvent were studied as a function of temperature in the range of 20-50°C using a Bruker Avance 400.132 MHz 1H NMR spectrometer. Based on the activation energy ( E a) and correlation time (τc), we believe that the Schiff base derivatives perform a molecular tumbling motion.

  17. Transversity 2005

    NASA Astrophysics Data System (ADS)

    Barone, Vincenzo; Ratcliffe, Philip G.

    Introduction. Purpose and status of the Italian Transversity Project / F. Bradamante -- Opening lecture. Transversity / M. Anselmino -- Experimental lectures. Azimuthal single-spin asymmetries from polarized and unpolarized hydrogen targets at HERMES / G. Schnell (for the HERMES Collaboration). Collins and Sivers asymmetries on the deuteron from COMPASS data / I. Horn (for the COMPASS Collaboration). First measurement of interference fragmentation on a transversely polarized hydrogen target / P. B. van der Nat (for the HERMES Collaboration). Two-hadron asymmetries at the COMPASS experiment / A. Mielech (for the COMPASS Collaboration). Measurements of chiral-odd fragmentation functions at Belle / R. Seidl ... [et al.]. Lambda asymmetries / A. Ferrero (for the COMPASS Collaboration). Transverse spin at PHENIX: results and prospects / C. Aidala (for the PHENIX Collaboration). Transverse spin and RHIC / L. Bland. Studies of transverse spin effects at JLab / H. Avakian ... [et al.] (for the CLAS Collaboration). Neutron transversity at Jefferson Lab / J. P. Chen ... [et al.] (for the Jefferson Lab Hall A Collaboration). PAX: polarized antiproton experiments / M. Contalbrigo. Single and double spin N-N interactions at GSI / M. Maggiora (for the ASSIA Collaboration). Spin filtering in storage rings / N. N. Nikolaev & F. F. Pavlov -- Theory lectures. Single-spin asymmetries and transversity in QCD / S. J. Brodsky. The relativistic hydrogen atom: a theoretical laboratory for structure functions / X. Artru & K. Benhizia. GPD's and SSA's / M. Burkardt. Time reversal odd distribution functions in chiral models / A. Drago. Soffer bound and transverse spin densities from lattice QCD / M. Diehl ... [et al.]. Single-spin asymmetries and Qiu-Sterman effect(s) / A. Bacchetta. Sivers function: SIDIS data, fits and predictions / M. Anselmino ... [et al.]. Twist-3 effects in semi-inclusive deep inelastic scattering / M. Schlegel, K. Goeke & A. Metz. Quark and gluon Sivers functions / I

  18. Changes in Porcine Muscle Water Characteristics during Growth—An in Vitro Low-Field NMR Relaxation Study

    NASA Astrophysics Data System (ADS)

    Bertram, Hanne Christine; Rasmussen, Marianne; Busk, Hans; Oksbjerg, Niels; Karlsson, Anders Hans; Andersen, Henrik Jørgen

    2002-08-01

    This study investigates the effects of developmental stage and muscle type on the mobility and distribution of water within skeletal muscles, using low-field 1H-NMR transverse relaxation measurements in vitro on four different porcine muscles ( M. longissimus dorsi, M. semitendinosus, M. biceps femoris, M. vastus intermedius) from a total of 48 pigs slaughtered at various weight classes between 25 kg and 150 kg. Principal component analysis (PCA) revealed effects of both slaughter weight and muscle type on the transverse relaxation decay. Independent of developmental stage and muscle type, distributed exponential analysis of the NMR T 2 relaxation data imparted the existence of three distinct water populations, T 2b, T 21, and T 22, with relaxation times of approximately 1-10, 45-120, and 200-500 ms, respectively. The most profound change during muscle growth was a shift toward faster relaxation in the intermediate time constant, T 21. It decreased by approx. 24% in all four muscle types during the period from 25 to 150 kg live weight. Determination of dry matter, fat, and protein content in the muscles showed that the changes in relaxation time of the intermediate time constant, T 21, during growth should be ascribed mainly to a change in protein content, as the protein content explained 77% of the variation in the T 21 time constant. Partial least squares (PLS) regression revealed validated correlations in the region of 0.58 to 0.77 between NMR transverse relaxation data and muscle development for all the four muscle types, which indicates that NMR relaxation measurements may be used in the prediction of muscle developmental stage.

  19. Transversity 2008

    NASA Astrophysics Data System (ADS)

    Giuseppe, Ciullo; Paolo, Lenisa; Marco, Contalbrigo; Delia, Hasch

    2009-04-01

    Purpose and status of the Italian transversity project / F. Bradamante -- Transversity asymmetries / D. Boer -- The transverse angular momentum sum rule / E. Leader -- Measurement of Collins and Sivers asymmetries at HERMES / L. L. Pappalardo (for the HERMES collaboration) -- Review of SSA results on deuteron at COMPASS / A. Richter (for the COMPASS collaboration) -- Single spin asymmetries on a transversely polarized proton target at COMPASS / S. Levorato (for the COMPASS collaboration) -- New preliminary results on the transversity distribution and the Collins fragmentation functions / M. Anselmino ... [et al.] -- Sivers effect in SIDIS pion and kaon production / M. Anselmino ... [et al.] -- Spin-orbit correlations / M. Burkardt -- Correlation functions in hard and (semi)-inclusive processes / M. Schlegel, S. Mei[symbol]ner and A. Metz -- Transversity via exclusive [pie symbol]-electroproduction / G. R. Goldstein, S. Liuti and S. Ahmad -- Estimate of the Sivers asymmetry at intermediate energies with rescattering extracted from exclusive processes / A. Bianconi -- Exclusively produced p[symbol] asymmetries on the deuteron and future GPD measurements at COMPASS / C. Schill (for the COMPASS collaboration) -- Transversity and transverse-momentum-dependent distribution measurements from PHENIX and BRAHMS / C. Aidala (for the PHENIX and BRAHMS collaborations) -- Sivers and Collins effects in polarized pp scattering processes / M. Anselmino ... [et al.] -- Sivers function in constituent quark models / S. Scopetta ... [et al.] -- Sivers, Boer-Mulders and transversity in Drell-Yan processes / M. Anselmino ... [et al.] -- TMDs and Drell-Yan experiments at Fermilab and J-PARC / J.-C. Peng -- Double polarisation observables at PAX / M. Nekipelov (for the PAX collaboration) -- Future Drell-Yan measurement @ COMPASS / M. Colantoni (for the COMPASS collaboration) -- Measurements of unpolarized azimuthal asymmetries at COMPASS / W. Käfer (for the COMPASS collaboration

  20. Picoliter 1H NMR Spectroscopy

    NASA Astrophysics Data System (ADS)

    Minard, Kevin R.; Wind, Robert A.

    2002-02-01

    In this study, a 267-μm-diameter solenoid transceiver is used to acquire localized 1H NMR spectra and the measured signal-to-noise ratio (SNR) at 500 MHz is shown to be within 20-30% of theoretical limits formulated by considering only its resistive losses. This is illustrated using a 100-μm-diameter globule of triacylglycerols (∼900 mM) that may be an oocyte precursor in young Xenopus laevis frogs and a water sample containing choline at a concentration often found in live mammalian cells (∼33 mM). In chemical shift imaging (CSI) experiments performed using a few thousand total scans, the choline methyl line is shown to have an acceptable SNR in resolved volume elements containing only 50 pL of sample, and localized spectra are resolved from just 5 pL in the Xenopus globule. These findings demonstrate the feasibility of performing 1H NMR on picoliter-scale sample volumes in biological cells and tissues and illustrate how the achieved SNR in spectroscopic images can be predicted with reasonable accuracy at microscopic spatial resolutions.

  1. Transverse myelitis

    SciTech Connect

    Black, M.J.; Motaghedi, B.; Robitaille, Y.

    1980-05-01

    Transverse myelitis is a known complication of radiation treatment for carcinoma of the heat and neck. In a five year period, 1970 to 1975, 120 patients with head and neck cancer received radiation as part of their treatment in this hospital. A review of the records of these patients showed only two cases of myelitis, an incidence of about 2%. This paper reviews the clinical syndrome; treatment and preventive measures are discussed and a survey of the literature is presented.

  2. Characterizing monoclonal antibody formulations in arginine glutamate solutions using 1H NMR spectroscopy

    PubMed Central

    Kheddo, Priscilla; Cliff, Matthew J.; Uddin, Shahid; van der Walle, Christopher F.; Golovanov, Alexander P.

    2016-01-01

    ABSTRACT Assessing how excipients affect the self-association of monoclonal antibodies (mAbs) requires informative and direct in situ measurements for highly concentrated solutions, without sample dilution or perturbation. This study explores the application of solution nuclear magnetic resonance (NMR) spectroscopy for characterization of typical mAb behavior in formulations containing arginine glutamate. The data show that the analysis of signal intensities in 1D 1H NMR spectra, when compensated for changes in buffer viscosity, is invaluable for identifying conditions where protein-protein interactions are minimized. NMR-derived molecular translational diffusion rates for concentrated solutions are less useful than transverse relaxation rates as parameters defining optimal formulation. Furthermore, NMR reports on the solution viscosity and mAb aggregation during accelerated stability study assessment, generating data consistent with that acquired by size-exclusion chromatography. The methodology developed here offers NMR spectroscopy as a new tool providing complementary information useful to formulation development of mAbs and other large therapeutic proteins. PMID:27589351

  3. High-power (1)H composite pulse decoupling provides artifact free exchange-mediated saturation transfer (EST) experiments.

    PubMed

    Chakrabarti, Kalyan S; Ban, David; Pratihar, Supriya; Reddy, Jithender G; Becker, Stefan; Griesinger, Christian; Lee, Donghan

    2016-08-01

    Exchange-mediated saturation transfer (EST) provides critical information regarding dynamics of molecules. In typical applications EST is studied by either scanning a wide range of (15)N chemical shift offsets where the applied (15)N irradiation field strength is on the order of hundreds of Hertz or, scanning a narrow range of (15)N chemical shift offsets where the applied (15)N irradiation field-strength is on the order of tens of Hertz during the EST period. The (1)H decoupling during the EST delay is critical as incomplete decoupling causes broadening of the EST profile, which could possibly result in inaccuracies of the extracted kinetic parameters and transverse relaxation rates. Currently two different (1)H decoupling schemes have been employed, intermittently applied 180° pulses and composite-pulse-decoupling (CPD), for situations where a wide range, or narrow range of (15)N chemical shift offsets are scanned, respectively. We show that high-power CPD provides artifact free EST experiments, which can be universally implemented regardless of the offset range or irradiation field-strengths. PMID:27240144

  4. High-power 1H composite pulse decoupling provides artifact free exchange-mediated saturation transfer (EST) experiments

    NASA Astrophysics Data System (ADS)

    Chakrabarti, Kalyan S.; Ban, David; Pratihar, Supriya; Reddy, Jithender G.; Becker, Stefan; Griesinger, Christian; Lee, Donghan

    2016-08-01

    Exchange-mediated saturation transfer (EST) provides critical information regarding dynamics of molecules. In typical applications EST is studied by either scanning a wide range of 15N chemical shift offsets where the applied 15N irradiation field strength is on the order of hundreds of Hertz or, scanning a narrow range of 15N chemical shift offsets where the applied 15N irradiation field-strength is on the order of tens of Hertz during the EST period. The 1H decoupling during the EST delay is critical as incomplete decoupling causes broadening of the EST profile, which could possibly result in inaccuracies of the extracted kinetic parameters and transverse relaxation rates. Currently two different 1H decoupling schemes have been employed, intermittently applied 180° pulses and composite-pulse-decoupling (CPD), for situations where a wide range, or narrow range of 15N chemical shift offsets are scanned, respectively. We show that high-power CPD provides artifact free EST experiments, which can be universally implemented regardless of the offset range or irradiation field-strengths.

  5. High-power (1)H composite pulse decoupling provides artifact free exchange-mediated saturation transfer (EST) experiments.

    PubMed

    Chakrabarti, Kalyan S; Ban, David; Pratihar, Supriya; Reddy, Jithender G; Becker, Stefan; Griesinger, Christian; Lee, Donghan

    2016-08-01

    Exchange-mediated saturation transfer (EST) provides critical information regarding dynamics of molecules. In typical applications EST is studied by either scanning a wide range of (15)N chemical shift offsets where the applied (15)N irradiation field strength is on the order of hundreds of Hertz or, scanning a narrow range of (15)N chemical shift offsets where the applied (15)N irradiation field-strength is on the order of tens of Hertz during the EST period. The (1)H decoupling during the EST delay is critical as incomplete decoupling causes broadening of the EST profile, which could possibly result in inaccuracies of the extracted kinetic parameters and transverse relaxation rates. Currently two different (1)H decoupling schemes have been employed, intermittently applied 180° pulses and composite-pulse-decoupling (CPD), for situations where a wide range, or narrow range of (15)N chemical shift offsets are scanned, respectively. We show that high-power CPD provides artifact free EST experiments, which can be universally implemented regardless of the offset range or irradiation field-strengths.

  6. Water proton spin saturation affects measured protein backbone 15 N spin relaxation rates

    NASA Astrophysics Data System (ADS)

    Chen, Kang; Tjandra, Nico

    2011-12-01

    Protein backbone 15N NMR spin relaxation rates are useful in characterizing the protein dynamics and structures. To observe the protein nuclear-spin resonances a pulse sequence has to include a water suppression scheme. There are two commonly employed methods, saturating or dephasing the water spins with pulse field gradients and keeping them unperturbed with flip-back pulses. Here different water suppression methods were incorporated into pulse sequences to measure 15N longitudinal T1 and transversal rotating-frame T1ρ spin relaxation. Unexpectedly the 15N T1 relaxation time constants varied significantly with the choice of water suppression method. For a 25-kDa Escherichiacoli. glutamine binding protein (GlnBP) the T1 values acquired with the pulse sequence containing a water dephasing gradient are on average 20% longer than the ones obtained using a pulse sequence containing the water flip-back pulse. In contrast the two T1ρ data sets are correlated without an apparent offset. The average T1 difference was reduced to 12% when the experimental recycle delay was doubled, while the average T1 values from the flip-back measurements were nearly unchanged. Analysis of spectral signal to noise ratios ( s/ n) showed the apparent slower 15N relaxation obtained with the water dephasing experiment originated from the differences in 1H N recovery for each relaxation time point. This in turn offset signal reduction from 15N relaxation decay. The artifact becomes noticeable when the measured 15N relaxation time constant is comparable to recycle delay, e.g., the 15N T1 of medium to large proteins. The 15N relaxation rates measured with either water suppression schemes yield reasonable fits to the structure. However, data from the saturated scheme results in significantly lower Model-Free order parameters (< S2> = 0.81) than the non-saturated ones (< S2> = 0.88), indicating such order parameters may be previously underestimated.

  7. Effects of time and temperature of firing on Fe-rich ceramics studied by Moessbauer spectroscopy and two-dimensional {sup 1}H-nuclear magnetic resonance relaxometry

    SciTech Connect

    Casieri, Cinzia; De Luca, Francesco; Nodari, Luca; Russo, Umberto; Terenzi, Camilla; Tudisca, Valentina

    2012-10-15

    The combined effects of firing temperature and soaking time on the microstructure of iron-rich porous ceramics have been studied by {sup 57}Fe-Moessbauer spectroscopy and 2D {sup 1}H nuclear magnetic resonance (NMR) relaxometry using a single-sided probe. Examining water-saturated ceramics using the relaxation correlation method, where longitudinal (T{sub 1}) and transverse (T{sub 2}) relaxation times are measured concurrently, provides information about firing-induced changes in both porosity (related to T{sub 1}) and magnetic properties (related to T{sub 2}). Comparing the information obtained from {sup 1}H-NMR analyses with that obtained from Moessbauer spectroscopy (which characterizes changes in iron-bearing species) shows that the T{sub 1}-T{sub 2} NMR correlation technique is very sensitive to even subtle modifications in the magnetic behavior of Fe-bearing species. Moreover, the single-sided NMR approach allows us to perform millimeter-scale depth-resolved measurements, which can be used to non-invasively study the microstructural heterogeneities associated with non-uniform firing effects inside ceramics. This is in contrast to Moessbauer spectroscopy, which requires that the ceramic samples be ground.

  8. Swelling of peat soil samples as determined by 1H NMR relaxometry

    NASA Astrophysics Data System (ADS)

    Jaeger, F.; Schaumann, G. E.

    2009-04-01

    The swelling of soil organic matter (SOM) rich samples like peat soils may affect sorption and desorption of nutrients and contaminants. In the course of swelling the state of water may change and SOM may form a gel phase. Two peat soil samples in different degradation states from one location in Germany were saturated with water. Their swelling kinetics were studied at 5°C, 19°C and 30°C using 1H NMR relaxometry at 7.5 MHz. CPMG pulse sequence and the inversion recovery method were used to determine transverse (T2) and longitudinal (T1) relaxation time distributions, respectively. The gel phase and the state of water were both characterized with 1H NMR relaxometry, Cryo-NMR and differential scanning calorimetry (DSC). Three types of water were found in both peats: Non-freezing bound water and two types of freezable water which showed a splitting of the melting peak in the DSC thermogram. The stepwise water drainage of the peat samples by centrifugation revealed increasing T1/T2 ratios, which were not caused by proton relaxation, due to spin diffusion in internal field gradients. It can be assumed that both the splitting of the melting peak and the increasing T1/T2 ratios were caused by a phase separation of the "free" freezable water as found for conventional biopolymers like starch. Due to the organic surfaces one phase of the freezable water is structured which affects the rotational motion of water molecules, and thus caused different T1 and T2 values. From the swelling kinetics three processes (fast, medium, slow) of water dislocation from larger to smaller T2 values were distinguished. The time constants of the processes were found to be in the range of minutes (fast), hours (medium) and days/weeks (slow). The activation energies ranged between 15 - 50 KJ mol-1 suggesting that physical and physical/chemical processes are governing the swelling of SOM like a sterical re-orientation of SOM macromolecules, the water-structuring and hydration of SOM.

  9. Relaxation System

    NASA Technical Reports Server (NTRS)

    1987-01-01

    Environ Corporation's relaxation system is built around a body lounge, a kind of super easy chair that incorporates sensory devices. Computer controlled enclosure provides filtered ionized air to create a feeling of invigoration, enhanced by mood changing aromas. Occupant is also surrounded by multidimensional audio and the lighting is programmed to change colors, patterns, and intensity periodically. These and other sensory stimulators are designed to provide an environment in which the learning process is stimulated, because research has proven that while an individual is in a deep state of relaxation, the mind is more receptive to new information.

  10. 1H NMR and calorimetric measurements on rabbit eye lenses.

    PubMed

    Gutsze, A; Bodurka, J; Olechnowicz, R; Buntkowsky, G; Limbach, H H

    1995-01-01

    The dynamic properties of water molecules in the rabbit lens were studied by proton nuclear magnetic resonance line shape analysis, measurements of relaxation times as a function of temperature and calorimetric measurements. The experiments prove, as already suggested by other authors, that there are two types of water in the lens of rabbit eyes, namely bound unfreezable hydration water and bulk freezable water. Line shape analysis and relaxometry showed, that this two types of water exist in two different environments, which may be identified as the nucleus and the cortex of the lens. The line shape analysis showed furthermore that water molecules in the rabbit lens has a common spin lattice relaxation time (T1), but two different transverse relaxation times (T2A and T2B). The tentative model of fast water exchange on the T1 time scale and slow water exchange on the T2 time scale, was used to explain experimental proton relaxation data of the rabbit lens. An estimation for this exchange rate kex by comparing it to the relaxation times is given (T1(-1) < kex < T1(-1)). It has also been shown by a calorimetric measurements, that the lenses can be easily under-cooled to temperatures well below the freezing point of water. The achievable maximum undercooling temperature of the lens is a function of the cooling rate KC, therefore it has to be considered as an experimentally adjustable parameter which is not characteristic for the investigated sample. Thus it must be noted that any previous discussions about the specific value of the temperature of water crystallisation in biological systems need to be carefully reconsidered.

  11. Solid state 1H NMR studies of cell wall materials of potatoes

    NASA Astrophysics Data System (ADS)

    Tang, Huiru; Belton, Peter S.; Ng, Annie; Waldron, Keith W.; Ryden, Peter

    1999-04-01

    Cell wall materials from potatoes ( Solanum tuberosum) prepared by two different methods have been studied using NMR proton relaxation times. Spin lattice relaxation in both the rotating and laboratory frames as well as transverse relaxation have been measured over a range of temperatures and hydration levels. It was observed that the sample prepared using a DMSO extraction showed anomalous behaviour of spin lattice relaxation in the laboratory frame probably due to residual solvent in the sample. Spin lattice relaxation in the laboratory frame is the result of hydroxymethyl rotation and another unidentified high frequency motion. In the rotating frame relaxation is adequately explained by hydroxymethyl rotation alone. In neither experiment is methyl group rotation observed, calculation suggests that this is due to the low density of methyl groups in the sample. Non-freezing water in potato cell walls, α-cellulose and pectin was found about 0.2, 0.04 and 0.18 g per gram dry matter, indicating preferable hydration of pectin compared to cellulose. The effects of hydration are most noticeable in the measurements that reflect low frequency motions, particularly transverse relaxation, where both second moments and the relative intensity of signals arising from immobile material are reduced by hydration.

  12. A VISTA on PD-1H.

    PubMed

    Liu, Yang

    2014-05-01

    Three years ago, two research groups independently identified a previously undescribed T cell cosignaling molecule; one referred to it as V-domain Ig suppressor of T cell activation (VISTA), and the other used the term programmed death-1 homolog (PD-1H). Recombinant and ectopically expressed PD-1H functions as a coinhibitory ligand for T cell responses. However, the function of endogenous PD-1H is not clear. In this issue of the JCI, Flies and colleagues demonstrate that endogenous PD-1H on both T cells and APCs serves as a coinhibitory molecule for T cell activation and provide further support for targeting PD-1H as a therapeutic strategy for transplantation and cancers.

  13. Magnetization Transfer Induced Biexponential Longitudinal Relaxation

    PubMed Central

    Prantner, Andrew M.; Bretthorst, G. Larry; Neil, Jeffrey J.; Garbow, Joel R.; Ackerman, Joseph J.H.

    2009-01-01

    Longitudinal relaxation of brain water 1H magnetization in mammalian brain in vivo is typically analyzed on a per voxel basis using a monoexponential model, thereby assigning a single relaxation time constant to all 1H magnetization within a given voxel. This approach was tested by obtaining inversion recovery data from grey matter of rats at 64 exponentially-spaced recovery times. Using Bayesian probability for model selection, brain water data were best represented by a biexponential function characterized by fast and slow relaxation components. At 4.7 T, the amplitude fraction of the rapidly relaxing component is 3.4 ± 0.7 % with a rate constant of 44 ± 12 s-1 (mean ± SD; 174 voxels from 4 rats). The rate constant of the slow relaxing component is 0.66 ± 0.04 s-1. At 11.7 T, the corresponding values are 6.9 ± 0.9 %, 19 ± 5 s-1, and 0.48 ± 0.02 s-1 (151 voxels from 4 rats). Several putative mechanisms for biexponential relaxation behavior were evaluated, and magnetization transfer between bulk water protons and non-aqueous protons was determined to be the source of biexponential longitudinal relaxation. MR methods requiring accurate quantification of longitudinal relaxation may need to take this effect explicitly into account. PMID:18759367

  14. Translational diffusion in paramagnetic liquids by 1H NMR relaxometry: Nitroxide radicals in solution

    NASA Astrophysics Data System (ADS)

    Kruk, D.; Korpała, A.; Kubica, A.; Meier, R.; Rössler, E. A.; Moscicki, J.

    2013-01-01

    For nitroxide radicals in solution one can identify three frequency regimes in which 1H spin-lattice relaxation rate of solvent molecules depend linearly on square root of the 1H resonance frequency. Combining a recently developed theory of nuclear (proton) spin-lattice relaxation in solutions of nitroxide radicals [D. Kruk et al., J. Chem. Phys. 137, 044512 (2012)], 10.1063/1.4736854 with properties of the spectral density function associated with translational dynamics, relationships between the corresponding linear changes of the relaxation rate (for 14N spin probes) and relative translational diffusion coefficient of the solvent and solute molecules have been derived (in analogy to 15N spin probes [E. Belorizky et al., J. Phys. Chem. A 102, 3674 (1998)], 10.1021/jp980397h). This method allows a simple and straightforward determination of diffusion coefficients in spin-labeled systems, by means of 1H nuclear magnetic resonance (NMR) relaxometry. The approach has thoroughly been tested by applying to a large set of experimental data—1H spin-lattice relaxation dispersion results for solutions of different viscosity (decalin, glycerol, propylene glycol) of 14N and 15N spin probes. The experiments have been performed versus temperature (to cover a broad range of translational diffusion coefficients) using field cycling spectrometer which covers three decades in 1H resonance frequency, 10 kHz-20 MHz. The limitations of NMR relaxometry caused by the time scale of the translational dynamics as well as electron spin relaxation have been discussed. It has been shown that for spin-labeled systems NMR relaxometry gives access to considerably faster diffusion processes than for diamagnetic systems.

  15. A new NMR method for determining the particle thickness in nanocomposites, using T2,H-selective X{1H} recoupling.

    PubMed

    Schmidt-Rohr, K; Rawal, A; Fang, X-W

    2007-02-01

    A new nuclear magnetic resonance approach for characterizing the thickness of phosphate, silicate, carbonate, and other nanoparticles in organic-inorganic nanocomposites is presented. The particle thickness is probed using the strongly distant-dependent dipolar couplings between the abundant protons in the organic phase and X nuclei (31P, 29Si, 13C, 27Al, 23Na, etc.) in the inorganic phase. This approach requires pulse sequences with heteronuclear dephasing only by the polymer or surface protons that experience strong homonuclear interactions, but not by dispersed OH or water protons in the inorganic phase, which have long transverse relaxation times T2,H. This goal is achieved by heteronuclear recoupling with dephasing by strong homonuclear interactions of protons (HARDSHIP). The pulse sequence alternates heteronuclear recoupling for approximately 0.15 ms with periods of homonuclear dipolar dephasing that are flanked by canceling 90 degrees pulses. The heteronuclear evolution of the long-T2,H protons is refocused within two recoupling periods, so that 1H spin diffusion cannot significantly dephase these coherences. For the short-T2,H protons of a relatively immobile organic matrix, the heteronuclear dephasing rate depends simply on the heteronuclear second moment. Homonuclear interactions do not affect the dephasing, even though no homonuclear decoupling is applied, because long-range 1H-X dipolar couplings approximately commute with short-range 1H-1H couplings, and heteronuclear recoupling periods are relatively short. This is shown in a detailed analysis based on interaction representations. The algorithm for simulating the dephasing data is described. The new method is demonstrated on a clay-polymer nanocomposite, diamond nanocrystals with protonated surfaces, and the bioapatite-collagen nanocomposite in bone, as well as pure clay and hydroxyapatite. The diameters of the nanoparticles in these materials range between 1 and 5 nm. Simulations show that spherical

  16. High-pressure low-field 1H NMR relaxometry in nanoporous materials.

    PubMed

    Horch, Carsten; Schlayer, Stefan; Stallmach, Frank

    2014-03-01

    A low-field NMR sensor with NdFeB permanent magnets (B0=118 mT) and a pressure cell made of PEEK (4 cm outer diameter) were designed for (1)H relaxation time studies of adsorbed molecules at pressures of up to 300 bar. The system was used to investigate methane uptake of microporous metal-organic frameworks and nanoporous activated carbon. T2 relaxation time distribution of pure methane and of methane under co-adsorption of carbon dioxide show that the host-guest interaction lead to a relaxation time contrasts, which may be used to distinguish between the gas phase and the different adsorbed phases of methane. Adsorption isotherms, exchange of methane between adsorbent particles and the surrounding gas phase, successive displacement of methane from adsorption sites by co-adsorption of carbon dioxide and CO2/CH4 adsorption separation factors were determined from the observed NMR relaxation time distributions.

  17. Optimization of 1H spin density for dynamic nuclear polarization using photo-excited triplet electron spins.

    PubMed

    Kagawa, Akinori; Murokawa, Yu; Takeda, Kazuyuki; Kitagawa, Masahiro

    2009-03-01

    In dynamic nuclear polarization (DNP) using photo-excited triplet electron spins, known as Microwave-Induced Optical Nuclear Polarization (MIONP), the attainable (1)H polarization is determined by the ratio of the buildup rate and the spin-lattice relaxation rate, in turn depend on the (1)H spin density. It is shown that the final (1)H polarization can be enhanced by diluting the (1)H spins with partial deuteration. The DNP experiments are demonstrated in 0.05 mol% pentacene-doped p-terphenyl for various (1)H abundances. It is also shown that the (1)H spin diffusion coefficient can be determined by examining the initial buildup rate of (1)H polarization for various repetition rates of the DNP sequence.

  18. Enhanced Y1H Assays for Arabidopis

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Transcription regulation plays a key role in development and response to environment. To understand this mechanism, we need to know which transcription factor (TFs) would bind to which promoter, thus regulate their target gene expression. Yeast one-hybrid (Y1H) technique can be used to map this kind...

  19. Breathing and Relaxation

    MedlinePlus

    ... Top Doctors in the Nation Departments & Divisions Home Health Insights Stress & Relaxation Breathing and Relaxation Breathing and Relaxation Make ... Management Assess Your Stress Coping Strategies Identifying ... & Programs Health Insights Doctors & Departments Research & Science Education & Training Make ...

  20. Spin relaxation in disordered media

    NASA Astrophysics Data System (ADS)

    Dzheparov, F. S.

    2011-10-01

    A review is given on theoretical grounds and typical experimental appearances of spin dynamics and relaxation in solids containing randomly distributed nuclear and/or electronic spins. Brief content is as follows. Disordered and magnetically diluted systems. General outlines of the spin transport theory. Random walks in disordered systems (RWDS). Observable values in phase spin relaxation, free induction decay (FID). Interrelation of longitudinal and transversal relaxation related to dynamics of occupancies and phases. Occupation number representation for equations of motion. Continuum media approximation and inapplicability of moment expansions. Long-range transitions vs percolation theory. Concentration expansion as a general constructive basis for analytical methods. Scaling properties of propagators. Singular point. Dynamical and kinematical memory in RWDS. Ways of regrouping of concentration expansions. CTRW and semi-phenomenology. Coherent medium approximation for nuclear relaxation via paramagnetic impurities. Combining of memory functions and cumulant expansions for calculation of FID. Path integral representations for RWDS. Numerical simulations of RWDS. Spin dynamics in magnetically diluted systems with low Zeeman and medium low dipole temperatures. Cluster expansions, regularization of dipole interactions and spectral dynamics.

  1. Relaxation Assessment with Varied Structured Milieu (RELAX).

    ERIC Educational Resources Information Center

    Cassel, Russell N.; Cassel, Susie L.

    1983-01-01

    Describes Relaxation Assessment with Varied Structured Milieu (RELAX), a clinical program designed to assess the degree to which an individual is able to demonstrate self-control for overall general relaxation. The program is designed for use with the Cassel Biosensors biofeedback equipment. (JAC)

  2. In vivo proton magnetic resonance spectroscopy of liver metabolites in non-alcoholic fatty liver disease in rats: T2 relaxation times in methylene protons.

    PubMed

    Song, Kyu-Ho; Baek, Hyeon-Man; Lee, Do-Wan; Choe, Bo-Young

    2015-10-01

    The aim of this study was to evaluate the transverse relaxation time of methylene resonance as compared to other lipid resonances. The examinations were performed using a 3.0 T scanner with a point-resolved spectroscopy (PRESS) sequence. Lipid relaxation time in a lipid phantom filled with canola oil was estimated with a repetition time (TR) of 6000ms and echo time (TE) of 40-550ms. For in vivo proton magnetic resonance spectroscopy ((1)H-MRS), eight male Sprague-Dawley rats were given free access to a normal-chow (NC) and another eight male Sprague-Dawley rats were given free access to a high-fat (HF) diet. Both groups drank water ad libitum. T2 measurements in the rats' livers were conducted at a fixed TR of 6000ms and TE of 40-220ms. Exponential curve fitting quality was calculated through the coefficients of determination (R(2)). Chemical analyses of the phantom and livers were not performed, but T2 decay curves were acquired. The T2 relaxation time of methylene resonance was estimated as follows: NC rats, 37.1±4.3ms; HF rats, 31.4±1.8ms (p<0.05). The extrapolated M0 values were higher in HF rats than in NC rats (p<0.005). This study of (1)H MRS led to sufficient spectral resolution and signal-to-noise ratio differences to characterize the T2 relaxation times of methylene resonance. (1)H MRS relaxation times may be useful for quantitative characterization of various liver diseases, including fatty liver disease.

  3. {sup 1}H nuclear magnetic resonance study of hydrated water dynamics in perfluorosulfonic acid ionomer Nafion

    SciTech Connect

    Han, Jun Hee; Lee, Kyu Won; Jeon, G. W.; Lee, Cheol Eui; Park, W. K.; Choi, E. H.

    2015-01-12

    We have studied the dynamics of hydrated water molecules in the proton exchange membrane of Nafion by means of high-resolution {sup 1}H nuclear magnetic resonance (NMR) measurements. “Bound” and “free” states of hydrated water clusters as well as the exchange protons were identified from the NMR chemical shift measurements, and their activation energies were obtained from the temperature-dependent laboratory- and rotating-frame spin-lattice relaxation measurements. Besides, a peculiar motional transition in the ultralow frequency region was observed at 373 K for the “free” hydrated water from the rotating-frame NMR spin-lattice relaxation time measurements.

  4. NMR T{sub 1} relaxation time measurements and calculations with translational and rotational components for liquid electrolytes containing LiBF{sub 4} and propylene carbonate

    SciTech Connect

    Richardson, P. M. Voice, A. M. Ward, I. M.

    2013-12-07

    Longitudinal relaxation (T{sub 1}) measurements of {sup 19}F, {sup 7}Li, and {sup 1}H in propylene carbonate/LiBF{sub 4} liquid electrolytes are reported. Comparison of T{sub 1} values with those for the transverse relaxation time (T{sub 2}) confirm that the measurements are in the high temperature (low correlation time) limit of the T{sub 1} minimum. Using data from pulsed field gradient measurements of self-diffusion coefficients and measurements of solution viscosity measured elsewhere, it is concluded that although in general there are contributions to T{sub 1} from both translational and rotational motions. For the lithium ions, this is mainly translational, and for the fluorine ions mainly rotational.

  5. Extraction of Transversity and Collins Functions

    SciTech Connect

    Anselmino, Mauro; Boglione, Mariaelena; D'Alesio, Umberto; Melis, Stefano; Murgia, Francesco; Prokudin, Alexei

    2014-01-01

    We present a global re-analysis of recent experimental data on azimuthal asymmetries in semi-inclusive deep inelastic scattering, from the HERMES and COMPASS Collaborations, and in e{sup +}e{sup -} --> h_1h_2X processes, from the Belle Collaboration. The transversity distribution and the Collins functions are extracted simultaneously, in a revised analysis which also takes into account a new parameterization of the unknown functions.

  6. Transversal magnetoresistance in Weyl semimetals

    NASA Astrophysics Data System (ADS)

    Klier, J.; Gornyi, I. V.; Mirlin, A. D.

    2015-11-01

    We explore theoretically the magnetoresistivity of three-dimensional Weyl and Dirac semimetals in transversal magnetic fields within two alternative models of disorder: (i) short-range impurities and (ii) charged (Coulomb) impurities. Impurity scattering is treated using the self-consistent Born approximation. We find that an unusual broadening of Landau levels leads to a variety of regimes of the resistivity scaling in the temperature-magnetic field plane. In particular, the magnetoresistance is nonmonotonous for the white-noise disorder model. For H →0 the magnetoresistance for short-range impurities vanishes in a nonanalytic way as H1 /3. In the limits of strongest magnetic fields H , the magnetoresistivity vanishes as 1 /H for pointlike impurities, while it is linear and positive in the model with Coulomb impurities.

  7. Preliminary 1H NMR study on archaeological waterlogged wood.

    PubMed

    Maccotta, Antonella; Fantazzini, Paola; Garavaglia, Carla; Donato, Ines D; Perzia, Patrizia; Brai, Maria; Morreale, Filippa

    2005-01-01

    Magnetic Resonance Relaxation (MRR) and Magnetic Resonance Imaging (MRI) are powerful tools to obtain detailed information on the pore space structure that one is unlikely to obtain in other ways. These techniques are particularly suitable for Cultural Heritage materials, because they use water 1H nuclei as a probe. Interaction with water is one of the main causes of deterioration of materials. Porous structure in wood, for example, favours the penetration of water, which can carry polluting substances and promote mould growth. A particular case is waterlogged wood from underwater discoveries and moist sites; in fact, these finds are very fragile because of chemical, physical and biological decay from the long contact with the water. When wood artefacts are brought to the surface and directly dried in air, there is the collapse of the cellular structures, and wood loses its original form and dimensions and cannot be used for study and museum exhibits. In this work we have undertaken the study of some wood finds coming from Ercolano's harbour by MRR and MRI under different conditions, and we have obtained a characterization of pore space in wood and images of the spatial distribution of the confined water in the wood. PMID:16485652

  8. Preliminary 1H NMR study on archaeological waterlogged wood.

    PubMed

    Maccotta, Antonella; Fantazzini, Paola; Garavaglia, Carla; Donato, Ines D; Perzia, Patrizia; Brai, Maria; Morreale, Filippa

    2005-01-01

    Magnetic Resonance Relaxation (MRR) and Magnetic Resonance Imaging (MRI) are powerful tools to obtain detailed information on the pore space structure that one is unlikely to obtain in other ways. These techniques are particularly suitable for Cultural Heritage materials, because they use water 1H nuclei as a probe. Interaction with water is one of the main causes of deterioration of materials. Porous structure in wood, for example, favours the penetration of water, which can carry polluting substances and promote mould growth. A particular case is waterlogged wood from underwater discoveries and moist sites; in fact, these finds are very fragile because of chemical, physical and biological decay from the long contact with the water. When wood artefacts are brought to the surface and directly dried in air, there is the collapse of the cellular structures, and wood loses its original form and dimensions and cannot be used for study and museum exhibits. In this work we have undertaken the study of some wood finds coming from Ercolano's harbour by MRR and MRI under different conditions, and we have obtained a characterization of pore space in wood and images of the spatial distribution of the confined water in the wood.

  9. Multislice 1H magnetic resonance spectroscopic imaging: assessment of epilepsy, Alzheimer's disease, and amyotrophic lateral sclerosis

    NASA Astrophysics Data System (ADS)

    Weiner, Michael W.; Maudsley, Andrew A.; Schuff, Norbert; Soher, Brian J.; Vermathen, Peter P.; Fein, George; Laxer, Kenneth D.

    1998-07-01

    Proton magnetic resonance spectroscopic imaging (1H MRSI) with volume pre-selection (i.e. by PRESS) or multislice 1H MRSI was used to investigate changes in brain metabolites in Alzheimer's disease, epilepsy, and amyotrophic lateral sclerosis. Examples of results from several ongoing clinical studies are provided. Multislice 1H MRSI of the human brain, without volume pre-selection offers considerable advantages over previously available techniques. Furthermore, MRI tissue segmentation and completely automated spectra curve fitting greatly facilitate quantitative data analysis. Future efforts will be devoted to obtaining full brain coverage and data acquisition at short spin echo times (TE less than 30 ms) for the detection of metabolites with short T2 relaxation times.

  10. 1H and 2H NMR studies of water in work-free wheat flour doughs.

    PubMed

    d'Avignon, D A; Hung, C C; Pagel, M T; Hart, B; Bretthorst, G L; Ackerman, J J

    1991-01-01

    Proton and deuterium NMR relaxation methods were used to characterize water compartmentalization and hydration in work-free wheat flour doughs. Transverse (spin-spin) relaxation measurements define three motionally unique water compartments in the work-free dough preparations. The apparent occupancy fraction and relative mobility of each water domain are found to be functions of moisture content, temperature, and flour type. Additionally, the number of relaxation-resolved water compartments and their characteristic relaxation rate constants are found to depend critically on both moisture content and the interpulse-delay employed for the multi-pulse relaxation experiments. Under controlled experimental conditions, dynamics between the three water compartments can be observed to be consistent with the onset of flour hydration. The most notable observation during the initial period of hydration is a loss of "free" or "loosely bound" water to environments characterized by less mobility. Freezing studies show that hard wheat doughs have slightly less amorphous, non-freezable water than do soft wheat flour doughs prepared under similar conditions. PMID:1746346

  11. Probing α-relaxation with nuclear magnetic resonance echo decay and relaxation: a study on nitrile butadiene rubber.

    PubMed

    Sturniolo, Simone; Pieruccini, Marco; Corti, Maurizio; Rigamonti, Attilio

    2013-01-01

    One dimensional (1)H NMR measurements have been performed to probe slow molecular motions in nitrile butadiene rubber (NBR) around its calorimetric glass transition temperature Tg. The purpose is to show how software aided data analysis can extract meaningful dynamical data from these measurements. Spin-lattice relaxation time, free induction decay (FID) and magic sandwich echo (MSE) measurements have been carried out at different values of the static field, as a function of temperature. It has been evidenced how the efficiency of the MSE signal in reconstructing the original FID exhibits a sudden minimum at a given temperature, with a slight dependence from the measuring frequency. Computer simulations performed with the software SPINEVOLUTION have shown that the minimum in the efficiency reconstruction of the MSE signal corresponds to the average motional frequency taking a value around the inter-proton coupling. The FID signals have been fitted with a truncated form of a newly derived exact correlation function for the transverse magnetization of a dipolar interacting spin pair, which allows one to avoid the restriction of the stationary and Gaussian approximations. A direct estimate of the conformational dynamics on approaching the Tg is obtained, and the results are in agreement with the analysis performed via the MSE reconstruction efficiency. The occurrence of a wide distribution of correlation frequencies for the chains motion, with a Vogel-Fulcher type temperature dependence, is addressed. A route for a fruitful study of the dynamics accompanying the glass transition by a variety of NMR measurements is thus proposed.

  12. Relaxation time and elasticity during polymerization with DER 332

    NASA Astrophysics Data System (ADS)

    Venkateshan, K.; Johari, G. P.

    2006-10-01

    To complement a study of the dielectric relaxation time's relation with the velocity of propagation of hypersound wave in a polymerizing liquid [K. Venkateshan and G. P. Johari J. Chem. Phys.125, 014907 (2006)], we report results of an analogous study by using the same diglycidylether of bisphenol-A that had been used for measuring the velocity. The data show that the logarithmic relaxation time increases linearly with the square of the velocity of propagation of transverse hypersound wave.

  13. Spatially localized sup 1 H NMR spectra of metabolites in the human brain

    SciTech Connect

    Hanstock, C.C. ); Rothman, D.L.; Jue, T.; Shulman, R.G. ); Prichard, J.W. )

    1988-03-01

    Using a surface coil, the authors have obtained {sup 1}H NMR spectra from metabolites in the human brain. Localization was achieved by combining depth pulses with image-selected in vivo spectroscopy magnetic field gradient methods. {sup 1}H spectra in which total creatine (3.03 ppm) has a signal/noise ratio of 95:1 were obtained in 4 min from 14 ml of brain. A resonance at 2.02 ppm consisting predominantly of N-acetylaspartate was measured relative to the creatine peak in gray and white matter, and the ratio was lower in the white matter. The spin-spin relaxation times of N-acetylaspartate and creatine were measured in white and gray matter and while creatine relaxation times were the same in both, the N-acetylaspartate relaxation time was longer in white matter. Lactate was detected in the normoxic brain and the average of three measurements was {approx}0.5 mM from comparison with the creatine plus phosphocreatine peak, which was assumed to be 10.5 mM.

  14. (19)F Paramagnetic Relaxation Enhancement: A Valuable Tool for Distance Measurements in Proteins.

    PubMed

    Matei, Elena; Gronenborn, Angela M

    2016-01-01

    Fluorine NMR paramagnetic relaxation enhancement was evaluated as a versatile approach for extracting distance information in selectively F-labeled proteins. Proof of concept and initial applications are presented for the HIV-inactivating lectin cyanovirin-N. Single F atoms were introduced at the 4-, 5-, 6- or 7 positions of Trp49 and the 4-position of Phe4, Phe54, and Phe80. The paramagnetic nitroxide spin label was attached to Cys residues that were placed into the protein at positions 50 or 52. (19)F-T2  NMR spectra with different relaxation delays were recorded and the transverse (19)F-PRE rate, (19)F-Γ2 , was used to determine the average distance between the F nucleus and the paramagnetic center. Our data show that experimental (19)F PRE-based distances correspond to 0.93 of the (1)HN-PRE distances, in perfect agreement with the gyromagnetic γ(19)F/γ(1)H ratio, thereby demonstrating that (19)F PREs are excellent alternative parameters for quantitative distance measurements in selectively F-labeled proteins.

  15. Transverse spin and transverse momentum in scattering of plane waves

    NASA Astrophysics Data System (ADS)

    Saha, Sudipta; Singh, Ankit K.; Ray, Subir K.; Banerjee, Ayan; Gupta, Subhasish Dutta; Ghosh, Nirmalya

    2016-10-01

    We study the near field to the far field evolution of spin angular momentum (SAM) density and the Poynting vector of the scattered waves from spherical scatterers. The results show that at the near field, the SAM density and the Poynting vector are dominated by their transverse components. While the former (transverse SAM) is independent of the helicity of the incident circular polarization state, the latter (transverse Poynting vector) depends upon the polarization state. It is further demonstrated that the magnitudes and the spatial extent of the transverse SAM and the transverse momentum components can be controllably enhanced by exploiting the interference of the transverse electric and transverse magnetic scattering modes.

  16. Spin relaxation of iron in mixed state hemoproteins.

    PubMed Central

    Wajnberg, E; Kalinowski, H J; Bemski, G; Helman, J S

    1986-01-01

    In hemoproteins the relaxation mechanism of iron is Orbach for high spin (HS) and Raman for low spin (LS). We found that in met-hemoglobin and met-myoglobin, under conditions in which the two spin states coexist, both the HS and the LS states relax to the lattice through Orbach-like processes. Alos, very short (approximately 1 ns) and temperature independent transverse relaxation times T2 were estimated. This may result from the unusual electronic structure of mixed states hemoproteins that allows thermal equilibrium and interconversion of the spin states. PMID:3013333

  17. Transverse colon conduit diversion

    SciTech Connect

    Schmidt, J.D.; Buchsbaum, H.J.

    1986-05-01

    The versatility and other advantages of the transverse colon conduit for urinary diversion have been described and implemented in 50 patients. Because most patients considered for this procedure will be at high risk because of a history of significant pelvic irradiation, underlying malignancy, poor renal function, fistula, and so forth, the technical details of surgery and patient selection cannot be minimized. The transverse colon segment is indicated for primary supravesical diversion as well as for salvage of problems related to ileal conduits. Adenocarcinoma of the colon is an unlikely long-term complication of this form of diversion because the fecal stream is absent. Now that the transverse colon conduit has been used for more than 10 years, meaningful comparisons with ileal segments should soon be available.

  18. [Development of functional 1H MRI probes based on nanoparticle design].

    PubMed

    Mizukami, Shin

    2013-01-01

    Visualization of biomolecules in living bodies has attracted increasing attention in recent years. Magnetic resonance imaging (MRI) is a noninvasive technique that yields high-resolution structural information of deep anatomical regions; therefore, it has promising applications in the development of probes to visualize biological functions. By using stimuli-responsive polymers, we developed (1)H MRI probes to measure the pH of aqueous solutions. The longitudinal relaxivity of P-Gd, a conjugate of n-octylamine-modified poly(SM-EVE) with Gd(3+) complexes, increased as the pH of the solution decreased from neutral to acidic. Fluorometric investigation confirmed that the side chains of P-Gd were more rotationally restricted in acidic pH than in neutral pH conditions. In order to improve the magnitude of relaxivity, we developed novel probes C10-Gd and C30-Gd on the basis of cross-linked polymer nanoparticles. The relaxivities of these probes were measured, and the values showed that these nanoparticle-based probes also possessed pH-responsive molecular switches. In addition, their relaxivities were much larger than those of non-cross-linked probes. These nanoparticle-based MRI probes would be useful for the diagnosis of various diseases such as cancer and inflammatory diseases.

  19. Nondiffracting transversally polarized beam.

    PubMed

    Yuan, G H; Wei, S B; Yuan, X-C

    2011-09-01

    Generation of a nondiffracting transversally polarized beam by means of transmitting an azimuthally polarized beam through a multibelt spiral phase hologram and then highly focusing by a high-NA lens is presented. A relatively long depth of focus (∼4.84λ) of the electric field with only radial and azimuthal components is achieved. The polarization of the wavefront near the focal plane is analyzed in detail by calculating the Stokes polarization parameters. It is found that the polarization is spatially varying and entirely transversally polarized, and the polarization singularity disappears at the beam center, which makes the central bright channel possible. PMID:21886250

  20. 31P NMR relaxation of cortical bone mineral at multiple magnetic field strengths and levels of demineralization.

    PubMed

    Seifert, Alan C; Wright, Alexander C; Wehrli, Suzanne L; Ong, Henry H; Li, Cheng; Wehrli, Felix W

    2013-09-01

    Recent work has shown that solid-state (1) H and (31) P MRI can provide detailed insight into bone matrix and mineral properties, thereby potentially enabling differentiation of osteoporosis from osteomalacia. However, (31) P MRI of bone mineral is hampered by unfavorable relaxation properties. Hence, accurate knowledge of these properties is critical to optimizing MRI of bone phosphorus. In this work, (31) P MRI signal-to-noise ratio (SNR) was predicted on the basis of T1 and T2 * (effective transverse relaxation time) measured in lamb bone at six field strengths (1.5-11.7 T) and subsequently verified by 3D ultra-short echo-time and zero echo-time imaging. Further, T1 was measured in deuterium-exchanged bone and partially demineralized bone. (31) P T2 * was found to decrease from 220.3 ± 4.3 µs to 98.0 ± 1.4 µs from 1.5 to 11.7 T, and T1 to increase from 12.8 ± 0.5 s to 97.3 ± 6.4 s. Deuteron substitution of exchangeable water showed that 76% of the (31) P longitudinal relaxation rate is due to (1) H-(31) P dipolar interactions. Lastly, hypomineralization was found to decrease T1, which may have implications for (31) P MRI based mineralization density quantification. Despite the steep decrease in the T2 */T1 ratio, SNR should increase with field strength as B0 (0.4) for sample-dominated noise and as B0 (1.1) for coil-dominated noise. This was confirmed by imaging experiments. PMID:23505120

  1. Protein corona affects the relaxivity and MRI contrast efficiency of magnetic nanoparticles

    NASA Astrophysics Data System (ADS)

    Amiri, Houshang; Bordonali, Lorenzo; Lascialfari, Alessandro; Wan, Sha; Monopoli, Marco P.; Lynch, Iseult; Laurent, Sophie; Mahmoudi, Morteza

    2013-08-01

    Magnetic nanoparticles (NPs) are increasingly being considered for use in biomedical applications such as biosensors, imaging contrast agents and drug delivery vehicles. In a biological fluid, proteins associate in a preferential manner with NPs. The small sizes and high curvature angles of NPs influence the types and amounts of proteins present on their surfaces. This differential display of proteins bound to the surface of NPs can influence the tissue distribution, cellular uptake and biological effects of NPs. To date, the effects of adsorption of a protein corona (PC) on the magnetic properties of NPs have not been considered, despite the fact that some of their potential applications require their use in human blood. Here, to investigate the effects of a PC (using fetal bovine serum) on the MRI contrast efficiency of superparamagnetic iron oxide NPs (SPIONs), we have synthesized two series of SPIONs with variation in the thickness and functional groups (i.e. surface charges) of the dextran surface coating. We have observed that different physico-chemical characteristics of the dextran coatings on the SPIONs lead to the formation of PCs of different compositions. 1H relaxometry was used to obtain the longitudinal, r1, and transverse, r2, relaxivities of the SPIONs without and with a PC, as a function of the Larmor frequency. The transverse relaxivity, which determines the efficiency of negative contrast agents (CAs), is very much dependent on the functional group and the surface charge of the SPIONs' coating. The presence of the PC did not alter the relaxivity of plain SPIONs, while it slightly increased the relaxivity of the negatively charged SPIONs and dramatically decreased the relaxivity of the positively charged ones, which was coupled with particle agglomeration in the presence of the proteins. To confirm the effect of the PC on the MRI contrast efficiency, in vitro MRI experiments at ν = 8.5 MHz were performed using a low-field MRI scanner. The MRI

  2. Protein corona affects the relaxivity and MRI contrast efficiency of magnetic nanoparticles

    NASA Astrophysics Data System (ADS)

    Amiri, Houshang; Bordonali, Lorenzo; Lascialfari, Alessandro; Wan, Sha; Monopoli, Marco P.; Lynch, Iseult; Laurent, Sophie; Mahmoudi, Morteza

    2013-08-01

    Magnetic nanoparticles (NPs) are increasingly being considered for use in biomedical applications such as biosensors, imaging contrast agents and drug delivery vehicles. In a biological fluid, proteins associate in a preferential manner with NPs. The small sizes and high curvature angles of NPs influence the types and amounts of proteins present on their surfaces. This differential display of proteins bound to the surface of NPs can influence the tissue distribution, cellular uptake and biological effects of NPs. To date, the effects of adsorption of a protein corona (PC) on the magnetic properties of NPs have not been considered, despite the fact that some of their potential applications require their use in human blood. Here, to investigate the effects of a PC (using fetal bovine serum) on the MRI contrast efficiency of superparamagnetic iron oxide NPs (SPIONs), we have synthesized two series of SPIONs with variation in the thickness and functional groups (i.e. surface charges) of the dextran surface coating. We have observed that different physico-chemical characteristics of the dextran coatings on the SPIONs lead to the formation of PCs of different compositions. 1H relaxometry was used to obtain the longitudinal, r1, and transverse, r2, relaxivities of the SPIONs without and with a PC, as a function of the Larmor frequency. The transverse relaxivity, which determines the efficiency of negative contrast agents (CAs), is very much dependent on the functional group and the surface charge of the SPIONs' coating. The presence of the PC did not alter the relaxivity of plain SPIONs, while it slightly increased the relaxivity of the negatively charged SPIONs and dramatically decreased the relaxivity of the positively charged ones, which was coupled with particle agglomeration in the presence of the proteins. To confirm the effect of the PC on the MRI contrast efficiency, in vitro MRI experiments at ν = 8.5 MHz were performed using a low-field MRI scanner. The MRI

  3. Transverse Spin at RHIC

    NASA Astrophysics Data System (ADS)

    Wang, Xiaorong

    2016-03-01

    In recent years, there has been exciting development in both experimental and theoretical studies of transverse spin asymmetries in polarized p+p and and DIS collisions. As a unique polarized proton-proton collider, Relativistic Heavy Ion Collider (RHIC) at Brookhaven National Laboratory (BNL) provides a unique opportunity to investigate the novel physics mechanisms that cause the large single spin asymmetry at the forward rapidity. Both PHENIX and STAR experiments have been studying the transverse spin asymmetries with a variety of final state particles in different kinematic regimes since 2006. Especially, recent theoretical development on scattering a polarized probe on the saturated nuclear may provide a unique way to probe the gluon and quark TMDs. RHIC successfully ran polarized p+Au collisions in 2015. We will expect to have new results from polarized d+Au to compare with existing results from p+p collision to extend our understanding of QCD. Further more, In 2015, PHENIX installed MPC-ex calorimeter at very forward region to measure direct photon AN and STAR installed Roman Pots to study the diffractive events in polarized p+p and p+Au collisions. The recent results on transverse polarized p+p and p+Au collisions from both PHENIX and STAR experiments will be presented in this talk. I will also briefly discuss the possibility for the transverse Spin program at future experiments sPHENIX and forward sPHENIX at RHIC. Supported by US Department of Energy and RIKEN Brookhaven Research Center.

  4. Bone mineral (31)P and matrix-bound water densities measured by solid-state (31)P and (1)H MRI.

    PubMed

    Seifert, Alan C; Li, Cheng; Rajapakse, Chamith S; Bashoor-Zadeh, Mahdieh; Bhagat, Yusuf A; Wright, Alexander C; Zemel, Babette S; Zavaliangos, Antonios; Wehrli, Felix W

    2014-07-01

    Bone is a composite material consisting of mineral and hydrated collagen fractions. MRI of bone is challenging because of extremely short transverse relaxation times, but solid-state imaging sequences exist that can acquire the short-lived signal from bone tissue. Previous work to quantify bone density via MRI used powerful experimental scanners. This work seeks to establish the feasibility of MRI-based measurement on clinical scanners of bone mineral and collagen-bound water densities, the latter as a surrogate of matrix density, and to examine the associations of these parameters with porosity and donors' age. Mineral and matrix-bound water images of reference phantoms and cortical bone from 16 human donors, aged 27-97 years, were acquired by zero-echo-time 31-phosphorus ((31)P) and 1-hydrogen ((1)H) MRI on whole body 7T and 3T scanners, respectively. Images were corrected for relaxation and RF inhomogeneity to obtain density maps. Cortical porosity was measured by micro-computed tomography (μCT), and apparent mineral density by peripheral quantitative CT (pQCT). MRI-derived densities were compared to X-ray-based measurements by least-squares regression. Mean bone mineral (31)P density was 6.74 ± 1.22 mol/l (corresponding to 1129 ± 204 mg/cc mineral), and mean bound water (1)H density was 31.3 ± 4.2 mol/l (corresponding to 28.3 ± 3.7 %v/v). Both (31)P and bound water (BW) densities were correlated negatively with porosity ((31)P: R(2) = 0.32, p < 0.005; BW: R(2) = 0.63, p < 0.0005) and age ((31)P: R(2) = 0.39, p < 0.05; BW: R(2) = 0.70, p < 0.0001), and positively with pQCT density ((31)P: R(2) = 0.46, p < 0.05; BW: R(2) = 0.50, p < 0.005). In contrast, the bone mineralization ratio (expressed here as the ratio of (31)P density to bound water density), which is proportional to true bone mineralization, was found to be uncorrelated with porosity, age or pQCT density. This work establishes the feasibility of image-based quantification of bone mineral and bound

  5. Relaxation selective pulses in fast relaxing systems.

    PubMed

    Lopez, Christopher J; Lu, Wei; Walls, Jamie D

    2014-05-01

    In this work, the selectivity or sharpness of the saturation profiles for relaxation selective pulses (R^rsps) that suppress magnetization possessing relaxation times of T2=T2(rsp) and T1=αT2 for α∈12,∞ was optimized. Along with sharpening the selectivity of the R^rsps, the selective saturation of these pulses was also optimized to be robust to both B0 and B1 inhomogeneities. Frequency-swept hyperbolic secant and adiabatic time-optimal saturation pulse inputs were found to work best in the optimizations, and the pulse lengths required to selectivity saturate the magnetization were always found to be less than the inversion recovery delay, T1ln(2). The selectivity of the optimized relaxation selective pulses was experimentally demonstrated in aqueous solutions with varying concentrations of the paramagnetic species, [Mn(+2)], and for use in solvent suppression. Finally, the "rotational" properties of spin relaxation were explored along with an analytical derivation of adiabatic time-optimal saturation pulses. PMID:24631803

  6. 1H NMR spectra part 31: 1H chemical shifts of amides in DMSO solvent.

    PubMed

    Abraham, Raymond J; Griffiths, Lee; Perez, Manuel

    2014-07-01

    The (1)H chemical shifts of 48 amides in DMSO solvent are assigned and presented. The solvent shifts Δδ (DMSO-CDCl3 ) are large (1-2 ppm) for the NH protons but smaller and negative (-0.1 to -0.2 ppm) for close range protons. A selection of the observed solvent shifts is compared with calculated shifts from the present model and from GIAO calculations. Those for the NH protons agree with both calculations, but other solvent shifts such as Δδ(CHO) are not well reproduced by the GIAO calculations. The (1)H chemical shifts of the amides in DMSO were analysed using a functional approach for near ( ≤ 3 bonds removed) protons and the electric field, magnetic anisotropy and steric effect of the amide group for more distant protons. The chemical shifts of the NH protons of acetanilide and benzamide vary linearly with the π density on the αN and βC atoms, respectively. The C=O anisotropy and steric effect are in general little changed from the values in CDCl3. The effects of substituents F, Cl, Me on the NH proton shifts are reproduced. The electric field coefficient for the protons in DMSO is 90% of that in CDCl3. There is no steric effect of the C=O oxygen on the NH proton in an NH…O=C hydrogen bond. The observed deshielding is due to the electric field effect. The calculated chemical shifts agree well with the observed shifts (RMS error of 0.106 ppm for the data set of 257 entries). PMID:24824670

  7. Increasing the sensitivity of NMR diffusion measurements by paramagnetic longitudinal relaxation enhancement, with application to ribosome–nascent chain complexes

    PubMed Central

    Cassaignau, Anaïs M. E.; Cabrita, Lisa D.

    2016-01-01

    The translational diffusion of macromolecules can be examined non-invasively by stimulated echo (STE) NMR experiments to accurately determine their molecular sizes. These measurements can be important probes of intermolecular interactions and protein folding and unfolding, and are crucial in monitoring the integrity of large macromolecular assemblies such as ribosome–nascent chain complexes (RNCs). However, NMR studies of these complexes can be severely constrained by their slow tumbling, low solubility (with maximum concentrations of up to 10 μM), and short lifetimes resulting in weak signal, and therefore continuing improvements in experimental sensitivity are essential. Here we explore the use of the paramagnetic longitudinal relaxation enhancement (PLRE) agent NiDO2A on the sensitivity of 15N XSTE and SORDID heteronuclear STE experiments, which can be used to monitor the integrity of these unstable complexes. We exploit the dependence of the PLRE effect on the gyromagnetic ratio and electronic relaxation time to accelerate recovery of 1H magnetization without adversely affecting storage on Nz during diffusion delays or introducing significant transverse relaxation line broadening. By applying the longitudinal relaxation-optimized SORDID pulse sequence together with NiDO2A to 70S Escherichia coli ribosomes and RNCs, NMR diffusion sensitivity enhancements of up to 4.5-fold relative to XSTE are achieved, alongside ~1.9-fold improvements in two-dimensional NMR sensitivity, without compromising the sample integrity. We anticipate these results will significantly advance the use of NMR to probe dynamic regions of ribosomes and other large, unstable macromolecular assemblies. PMID:26253948

  8. Electronic states and molecular dynamics of single-component molecular conductors [M (tmdt) 2] (M =Ni , Pt) studied by 13C and 1H NMR

    NASA Astrophysics Data System (ADS)

    Takagi, Rina; Miyagawa, Kazuya; Yoshimura, Masahide; Gangi, Hiro; Kanoda, Kazushi; Zhou, Biao; Idobata, Yuki; Kobayashi, Akiko

    2016-01-01

    The molecular conductors [M(tmdt) 2] (M =Ni , Pt) consisting of single molecular species are investigated with 13C NMR and 1H NMR. The temperature dependences of the 13C NMR shift and relaxation rate provide microscopic evidence for the metallic nature with appreciable electron correlations. Both compounds exhibit an anomalous frequency-dependent enhancement in the 1H nuclear spin-lattice relaxation rate in a wide temperature range. These observations signify the presence of extraordinary molecular motions with low energy excitations.

  9. Partonic Transverse Momentum Distributions

    SciTech Connect

    Rossi, Patrizia

    2010-08-04

    In recent years parton distributions have been generalized to account also for transverse degrees of freedom and new sets of more general distributions, Transverse Momentum Dependent (TMD) parton distributions and fragmentation functions were introduced. Different experiments worldwide (HERMES, COMPASS, CLAS, JLab-Hall A) have measurements of TMDs in semi-inclusive DIS processes as one of their main focuses of research. TMD studies are also an important part of the present and future Drell-Yan experiments at RICH and JPARC and GSI, respectively, Studies of TMDs are also one of the main driving forces of the Jefferson Lab (JLab) 12 GeV upgrade project. Progress in phenomenology and theory is flourishing as well. In this talk an overview of the latest developments in studies of TMDs will be given and newly released results, ongoing activities, as well as planned near term and future measurements will be discussed.

  10. Transverse testicular ectopia.

    PubMed

    Yıldız, Abdullah; Yiğiter, Murat; Oral, Akgün; Bakan, Vedat

    2014-02-01

    Described herein are six cases of transverse testicular ectopia. All patients who underwent orchidopexy at the one pediatric surgical unit between October 2001 and January 2008 were evaluated. The medical records of all patients diagnosed with transverse testicular ectopia were evaluated retrospectively. Five patients (84%) were admitted with a symptomatic right inguinal hernia and empty scrotum on the left side. Only one child (16%) had left-sided hernia and right non-palpable testis (age ranged from 1 month to 3 years). Four patients (66%) were diagnosed in the operating theatre and the last two (33%) on inguinal ultrasound preoperatively. Magnetic resonance imaging was also performed in the last patient. Herniorrhaphy with fixation of the ectopic gonad to the opposite hemiscrotum through a transseptal incision was performed in all patients. Postoperative complications were not observed. PMID:24548194

  11. Dynamic behaviour of water in hydrogel containing hydrophobic side chains as studied by pulse 1H NMR

    NASA Astrophysics Data System (ADS)

    Yasunaga, H.; Shirakawa, Y.; Urakawa, H.; Kajiwara, K.

    2002-01-01

    1H NMR measurements on spin-lattice relaxation time ( T1) and spin-spin relaxation time ( T2) were carried out on water contained in water-swollen copolymer gels prepared from hydrophilic methacrylic acid and hydrophobic stearyl methacrylate (SMA) or lauryl methacrylate (LMA). The degree of swelling of the copolymer gels decreases drastically with increasing component of hydrophobic monomers. 1H T1 and T2 of water show linear relationship with the cube root of the degree of swelling. Motion of water is restrained with the decreasing network size and the amount of hydrophobic groups in the network. T1 measurements with temperature change revealed that the hydrogen bondings in water are decreased by introducing hydrophobic groups into the hydro gel..

  12. Nuclear relaxation in an electric field enables the determination of isotropic magnetic shielding

    NASA Astrophysics Data System (ADS)

    Garbacz, Piotr

    2016-08-01

    It is shown that in contrast to the case of nuclear relaxation in a magnetic field B, simultaneous application of the magnetic field B and an additional electric field E causes transverse relaxation of a spin-1/2 nucleus with the rate proportional to the square of the isotropic part of the magnetic shielding tensor. This effect can contribute noticeably to the transverse relaxation rate of heavy nuclei in molecules that possess permanent electric dipole moments. Relativistic quantum mechanical computations indicate that for 205Tl nucleus in a Pt-Tl bonded complex, Pt(CN)5Tl, the transverse relaxation rate induced by the electric field is of the order of 1 s-1 at E = 5 kV/mm and B = 10 T.

  13. Bone tissue and porous media: common features and differences studied by NMR relaxation.

    PubMed

    Fantazzini, Paola; Brown, Robert James Sidford; Borgia, Giulio Cesare

    2003-01-01

    the GC, which is presumed to be 1H on collagen, leads to the T2 reduction of at least part of the LLC, which is presumed to be water. Progressive drying of the cleaned and water-saturated samples confirms that the long T1 and T2 components were in the large intertrabecular spaces, since the corresponding peaks are lost. Further drying leads to further shortening of T2 for the remaining water but eventually leads to lengthening of T1 for both the collagen and the water. After the intertrabecular water is lost by drying, T1 is the same for GC and LLC. T(2-FID) is found to be roughly 320/alpha micros, where alpha is the ratio of the extrapolated GC to LLC, appearing to indicate a time tau of about 320 micros for 1H transverse magnetization in GC to exchange with that of LLC. This holds for all samples and under all conditions investigated. The role of the collagen in relaxation is confirmed by treatment to remove the mineral component, observing that the GC remains and has the same TGC and has the same effect on the relaxation times of the associated water. Measurements on cortical bone show the same collagen-related effects but do not have the long T1 and T2 components.

  14. Spin-echo sup 1 H NMR studies of differential mobility in gizzard myosin and its subfragments

    SciTech Connect

    Sommervile, L.E. ); Henry, G.D.; Sykes, B.D. ); Harshorne, D.J. )

    1990-12-01

    The unexpectedly narrow resonances in the {sup 1}H NMR spectra of gizzard myosin, heavy meromyosin, and subfragment 1 were examined by spin-echo NMR spectroscopy. These resonances originated predominantly in the myosin heads, or subfragment 1 units. Smooth muscle myosin undergoes a dramatic change in hydrodynamic properties and can exist either as a folded (10S) or as an extended (6S) species. Factors that influence this transition, namely, ionic strength and phosphorylation (or thiophosphorylation), were varied in the NMR experiments. T{sub 2} relaxation experiments on dephosphorylated myosin indicated several components of different relaxation times that were not influenced by changes in ionic strength. The experiments focused on the components with longer relaxation times, i.e., corresponding to nuclei with more mobility, and these were observed selectively in a spin-echo experiment. With dephosphorylated myosin and HMM, increases in ionic strength caused an increased intensity in several of the narrower resonances. The ionic strength dependence of these changes paralleled that for the 10S and 6S transition. With thiophosphorylated myosin and HMM, changes in ionic strength also influenced the intensities of the narrower resonances, and in addition changes in the {sup 1}H NMR spectrum due to thiophosphorylation were observed. These results suggest that a fraction of the {sup 1}H resonances in smooth muscle myosin and its fragments originates from both aliphatic and aromatic residues of increased mobility compared to the mobility expected from hydrodynamic properties of these proteins.

  15. [Main relaxation techniques].

    PubMed

    Mateos Rodilla, Juana

    2002-11-01

    After having provided a detailed explanation on what relaxation consists of (see Rev. Rol Enf 2002; 25(9):582-586), the author presents a recap of the major known relaxation techniques including progressive muscular therapy, yoga stretching exercises, breathing techniques, therapeutic massages, meditation,... emphasizing the theoretical basis and practical experience as a function of each technique; each person ought to adopt those techniques which are most appropriate.

  16. The in vivo relaxivity of MRI contrast agents

    NASA Astrophysics Data System (ADS)

    Shuter, Borys

    1999-11-01

    Post-contrast clinical 1H Magnetic Resonance Images have to date been interpreted with little regard for possible variations in the in-vivo properties of injected magnetic pharmaceuticals (contrast agents), particularly in their relaxivity or ability to alter tissue relaxation rates, T2-1 and T 2-1, per unit concentration. The relaxivities of contrast agents have only rarely been measured in-vivo, measurements usually being performed on excised tissues and at magnetic field strengths lower than used in clinical practice. Some researchers have simply assumed that relaxivities determined in homogeneous tissue phantoms were applicable in-vivo. In this thesis, the relaxivities of two contrast agents, Gd-DTPA and Gd-EOB-DTPA, were measured in simple tissue phantoms and in the kidney and liver of intact, but sacrificed, Wistar rats using a clinical MR scanner with a magnetic field of 1.5 Tesla. T1 and T2 were determined from sets of images acquired using a standard clinical spin-echo pulse sequence. The contrast agent concentration in tissue was assessed by radioassay of 153Gd-DTPA or 153Gd-EOB-DTPA, mixed with the normal compound prior to injection. Relaxivity was taken as the slope of a linear regression fit of relaxation rate against Gd concentration. The relaxivities of Gd-EOB-DTPA were similarly determined in normal and biliary- obstructed guinea pigs. Relaxivities in tissue differed significantly from values obtained in simple phantoms. Kidney T1 relaxivity was reduced for both compounds in normal animals. Three days or more of biliary obstruction produced further reductions in kidney T1 relaxivity of Gd-EOB-DTPA, providing strong evidence that disease affects contrast agent relaxivity. Kidney T2 relaxivity was much greater than T1 relaxivity and was also depressed by biliary obstruction. Liver T1 and T 2 relaxivites were increased above phantom values, but were not affected by the biliary obstruction. Water compartmentalisation, macromolecular binding, proton

  17. Neutron Transversity at Jefferson Lab

    SciTech Connect

    Jian-Ping Chen; Xiaodong Jiang; Jen-chieh Peng; Lingyan Zhu

    2005-09-07

    Nucleon transversity and single transverse spin asymmetries have been the recent focus of large efforts by both theorists and experimentalists. On-going and planned experiments from HERMES, COMPASS and RHIC are mostly on the proton or the deuteron. Presented here is a planned measurement of the neutron transversity and single target spin asymmetries at Jefferson Lab in Hall A using a transversely polarized {sup 3}He target. Also presented are the results and plans of other neutron transverse spin experiments at Jefferson Lab. Finally, the factorization for semi-inclusive DIS studies at Jefferson Lab is discussed.

  18. Selective excitation enables assignment of proton resonances and (1)H-(1)H distance measurement in ultrafast magic angle spinning solid state NMR spectroscopy.

    PubMed

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-07-21

    Remarkable developments in ultrafast magic angle spinning (MAS) solid-state NMR spectroscopy enabled proton-based high-resolution multidimensional experiments on solids. To fully utilize the benefits rendered by proton-based ultrafast MAS experiments, assignment of (1)H resonances becomes absolutely necessary. Herein, we propose an approach to identify different proton peaks by using dipolar-coupled heteronuclei such as (13)C or (15)N. In this method, after the initial preparation of proton magnetization and cross-polarization to (13)C nuclei, transverse magnetization of desired (13)C nuclei is selectively prepared by using DANTE (Delays Alternating with Nutations for Tailored Excitation) sequence and then, it is transferred to bonded protons with a short-contact-time cross polarization. Our experimental results demonstrate that protons bonded to specific (13)C atoms can be identified and overlapping proton peaks can also be assigned. In contrast to the regular 2D HETCOR experiment, only a few 1D experiments are required for the complete assignment of peaks in the proton spectrum. Furthermore, the finite-pulse radio frequency driven recoupling sequence could be incorporated right after the selection of specific proton signals to monitor the intensity buildup for other proton signals. This enables the extraction of (1)H-(1)H distances between different pairs of protons. Therefore, we believe that the proposed method will greatly aid in fast assignment of peaks in proton spectra and will be useful in the development of proton-based multi-dimensional solid-state NMR experiments to study atomic-level resolution structure and dynamics of solids. PMID:26203019

  19. Selective excitation enables assignment of proton resonances and (1)H-(1)H distance measurement in ultrafast magic angle spinning solid state NMR spectroscopy.

    PubMed

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-07-21

    Remarkable developments in ultrafast magic angle spinning (MAS) solid-state NMR spectroscopy enabled proton-based high-resolution multidimensional experiments on solids. To fully utilize the benefits rendered by proton-based ultrafast MAS experiments, assignment of (1)H resonances becomes absolutely necessary. Herein, we propose an approach to identify different proton peaks by using dipolar-coupled heteronuclei such as (13)C or (15)N. In this method, after the initial preparation of proton magnetization and cross-polarization to (13)C nuclei, transverse magnetization of desired (13)C nuclei is selectively prepared by using DANTE (Delays Alternating with Nutations for Tailored Excitation) sequence and then, it is transferred to bonded protons with a short-contact-time cross polarization. Our experimental results demonstrate that protons bonded to specific (13)C atoms can be identified and overlapping proton peaks can also be assigned. In contrast to the regular 2D HETCOR experiment, only a few 1D experiments are required for the complete assignment of peaks in the proton spectrum. Furthermore, the finite-pulse radio frequency driven recoupling sequence could be incorporated right after the selection of specific proton signals to monitor the intensity buildup for other proton signals. This enables the extraction of (1)H-(1)H distances between different pairs of protons. Therefore, we believe that the proposed method will greatly aid in fast assignment of peaks in proton spectra and will be useful in the development of proton-based multi-dimensional solid-state NMR experiments to study atomic-level resolution structure and dynamics of solids.

  20. Selective excitation enables assignment of proton resonances and {sup 1}H-{sup 1}H distance measurement in ultrafast magic angle spinning solid state NMR spectroscopy

    SciTech Connect

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-07-21

    Remarkable developments in ultrafast magic angle spinning (MAS) solid-state NMR spectroscopy enabled proton-based high-resolution multidimensional experiments on solids. To fully utilize the benefits rendered by proton-based ultrafast MAS experiments, assignment of {sup 1}H resonances becomes absolutely necessary. Herein, we propose an approach to identify different proton peaks by using dipolar-coupled heteronuclei such as {sup 13}C or {sup 15}N. In this method, after the initial preparation of proton magnetization and cross-polarization to {sup 13}C nuclei, transverse magnetization of desired {sup 13}C nuclei is selectively prepared by using DANTE (Delays Alternating with Nutations for Tailored Excitation) sequence and then, it is transferred to bonded protons with a short-contact-time cross polarization. Our experimental results demonstrate that protons bonded to specific {sup 13}C atoms can be identified and overlapping proton peaks can also be assigned. In contrast to the regular 2D HETCOR experiment, only a few 1D experiments are required for the complete assignment of peaks in the proton spectrum. Furthermore, the finite-pulse radio frequency driven recoupling sequence could be incorporated right after the selection of specific proton signals to monitor the intensity buildup for other proton signals. This enables the extraction of {sup 1}H-{sup 1}H distances between different pairs of protons. Therefore, we believe that the proposed method will greatly aid in fast assignment of peaks in proton spectra and will be useful in the development of proton-based multi-dimensional solid-state NMR experiments to study atomic-level resolution structure and dynamics of solids.

  1. Selective excitation enables assignment of proton resonances and 1H-1H distance measurement in ultrafast magic angle spinning solid state NMR spectroscopy

    NASA Astrophysics Data System (ADS)

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-07-01

    Remarkable developments in ultrafast magic angle spinning (MAS) solid-state NMR spectroscopy enabled proton-based high-resolution multidimensional experiments on solids. To fully utilize the benefits rendered by proton-based ultrafast MAS experiments, assignment of 1H resonances becomes absolutely necessary. Herein, we propose an approach to identify different proton peaks by using dipolar-coupled heteronuclei such as 13C or 15N. In this method, after the initial preparation of proton magnetization and cross-polarization to 13C nuclei, transverse magnetization of desired 13C nuclei is selectively prepared by using DANTE (Delays Alternating with Nutations for Tailored Excitation) sequence and then, it is transferred to bonded protons with a short-contact-time cross polarization. Our experimental results demonstrate that protons bonded to specific 13C atoms can be identified and overlapping proton peaks can also be assigned. In contrast to the regular 2D HETCOR experiment, only a few 1D experiments are required for the complete assignment of peaks in the proton spectrum. Furthermore, the finite-pulse radio frequency driven recoupling sequence could be incorporated right after the selection of specific proton signals to monitor the intensity buildup for other proton signals. This enables the extraction of 1H-1H distances between different pairs of protons. Therefore, we believe that the proposed method will greatly aid in fast assignment of peaks in proton spectra and will be useful in the development of proton-based multi-dimensional solid-state NMR experiments to study atomic-level resolution structure and dynamics of solids.

  2. Transverse field focused system

    DOEpatents

    Anderson, Oscar A.

    1986-01-01

    A transverse field focused (TFF) system for transport or acceleration of an intense sheet beam of negative ions in which a serial arrangement of a plurality of pairs of concentric cylindrical-arc electrodes is provided. Acceleration of the sheet beam can be achieved by progressively increasing the mean electrode voltage of successive electrode pairs. Because the beam is curved by the electrodes, the system can be designed to transport the beam through a maze passage which is baffled to prevent line of sight therethrough. Edge containment of the beam can be achieved by shaping the side edges of the electrodes to produce an electric force vector directed inwardly from the electrode edges.

  3. The interaction of small molecules with phospholipid membranes studied by 1H NOESY NMR under magic-angle spinning.

    PubMed

    Scheidt, Holger A; Huster, Daniel

    2008-01-01

    The interaction of small molecules with lipid membranes and the exact knowledge of their binding site and bilayer distribution is of great pharmacological importance and represents an active field of current biophysical research. Over the last decade, a highly resolved 1H solid-state NMR method has been developed that allows measuring localization and distribution of small molecules in membranes. The classical solution 1H NMR NOESY technique is applied to lipid membrane samples under magic-angle spinning (MAS) and NOESY cross-relaxation rates are determined quantitatively. These rates are proportional to the contact probability between molecular segments and therefore an ideal tool to study intermolecular interactions in membranes. Here, we review recent 1H MAS NOESY applications that were carried out to study lateral lipid organization in mixed membranes and the interaction of membranes with water, ethanol, small aromatic compounds, peptides, fluorescence labels, and lipophilic nucleosides.

  4. Transverse Compression of Tendons.

    PubMed

    Salisbury, S T Samuel; Buckley, C Paul; Zavatsky, Amy B

    2016-04-01

    A study was made of the deformation of tendons when compressed transverse to the fiber-aligned axis. Bovine digital extensor tendons were compression tested between flat rigid plates. The methods included: in situ image-based measurement of tendon cross-sectional shapes, after preconditioning but immediately prior to testing; multiple constant-load creep/recovery tests applied to each tendon at increasing loads; and measurements of the resulting tendon displacements in both transverse directions. In these tests, friction resisted axial stretch of the tendon during compression, giving approximately plane-strain conditions. This, together with the assumption of a form of anisotropic hyperelastic constitutive model proposed previously for tendon, justified modeling the isochronal response of tendon as that of an isotropic, slightly compressible, neo-Hookean solid. Inverse analysis, using finite-element (FE) simulations of the experiments and 10 s isochronal creep displacement data, gave values for Young's modulus and Poisson's ratio of this solid of 0.31 MPa and 0.49, respectively, for an idealized tendon shape and averaged data for all the tendons and E = 0.14 and 0.10 MPa for two specific tendons using their actual measured geometry. The compression load versus displacement curves, as measured and as simulated, showed varying degrees of stiffening with increasing load. This can be attributed mostly to geometrical changes in tendon cross section under load, varying according to the initial 3D shape of the tendon. PMID:26833218

  5. Transverse Compression of Tendons.

    PubMed

    Salisbury, S T Samuel; Buckley, C Paul; Zavatsky, Amy B

    2016-04-01

    A study was made of the deformation of tendons when compressed transverse to the fiber-aligned axis. Bovine digital extensor tendons were compression tested between flat rigid plates. The methods included: in situ image-based measurement of tendon cross-sectional shapes, after preconditioning but immediately prior to testing; multiple constant-load creep/recovery tests applied to each tendon at increasing loads; and measurements of the resulting tendon displacements in both transverse directions. In these tests, friction resisted axial stretch of the tendon during compression, giving approximately plane-strain conditions. This, together with the assumption of a form of anisotropic hyperelastic constitutive model proposed previously for tendon, justified modeling the isochronal response of tendon as that of an isotropic, slightly compressible, neo-Hookean solid. Inverse analysis, using finite-element (FE) simulations of the experiments and 10 s isochronal creep displacement data, gave values for Young's modulus and Poisson's ratio of this solid of 0.31 MPa and 0.49, respectively, for an idealized tendon shape and averaged data for all the tendons and E = 0.14 and 0.10 MPa for two specific tendons using their actual measured geometry. The compression load versus displacement curves, as measured and as simulated, showed varying degrees of stiffening with increasing load. This can be attributed mostly to geometrical changes in tendon cross section under load, varying according to the initial 3D shape of the tendon.

  6. Transversity and Collins Fragmentation Functions: Towards a New Global Analysis

    SciTech Connect

    Anselmino, M.; Boglione, M.; Melis, S.; Prokudin, A.; D'Alesio, U.; Kotzinian, A.; Murgia, F.

    2009-08-04

    We present an update of a previous global analysis of the experimental data on azimuthal asymmetries in semi-inclusive deep inelastic scattering (SIDIS), from the HERMES and COMPASS Collaborations, and in e{sup +}e{sup -}{yields}h{sub 1}h{sub 2}X processes, from the Belle Collaboration. Compared to the first extraction, a more precise determination of the Collins fragmentation function and the transversity distribution function for u and d quarks is obtained.

  7. Teaching 1H NMR Spectrometry Using Computer Modeling.

    ERIC Educational Resources Information Center

    Habata, Yoichi; Akabori, Sadatoshi

    2001-01-01

    Molecular modeling by computer is used to display stereochemistry, molecular orbitals, structure of transition states, and progress of reactions. Describes new ideas for teaching 1H NMR spectroscopy using computer modeling. (Contains 12 references.) (ASK)

  8. Transverse Wobbling in 135Pr

    NASA Astrophysics Data System (ADS)

    Matta, J. T.; Garg, U.; Li, W.; Frauendorf, S.; Ayangeakaa, A. D.; Patel, D.; Schlax, K. W.; Palit, R.; Saha, S.; Sethi, J.; Trivedi, T.; Ghugre, S. S.; Raut, R.; Sinha, A. K.; Janssens, R. V. F.; Zhu, S.; Carpenter, M. P.; Lauritsen, T.; Seweryniak, D.; Chiara, C. J.; Kondev, F. G.; Hartley, D. J.; Petrache, C. M.; Mukhopadhyay, S.; Lakshmi, D. Vijaya; Raju, M. Kumar; Madhusudhana Rao, P. V.; Tandel, S. K.; Ray, S.; Dönau, F.

    2015-02-01

    A pair of transverse wobbling bands is observed in the nucleus 135Pr . The wobbling is characterized by Δ I =1 , E 2 transitions between the bands, and a decrease in the wobbling energy confirms its transverse nature. Additionally, a transition from transverse wobbling to a three-quasiparticle band comprised of strong magnetic dipole transitions is observed. These observations conform well to results from calculations with the tilted axis cranking model and the quasiparticle rotor model.

  9. Transverse Spin Effects at COMPASS

    SciTech Connect

    Wollny, H.

    2009-08-04

    The measurement of transverse spin effects in semi-inclusive deep-inelastic scattering (SIDIS) is an important part of the COMPASS physics program. In the years 2002-2004 data was taken by scattering a 160 GeV/c muon beam off a transversely polarized deuteron target. In 2007, additional data was collected on a transversely polarized proton target. New preliminary results for the Collins and Sivers asymmetries from the analysis of the proton data are presented.

  10. Pediatric transverse myelitis.

    PubMed

    Absoud, Michael; Greenberg, Benjamin M; Lim, Ming; Lotze, Tim; Thomas, Terrence; Deiva, Kumaran

    2016-08-30

    Pediatric acute transverse myelitis (ATM) is an immune-mediated CNS disorder and contributes to 20% of children experiencing a first acquired demyelinating syndrome (ADS). ATM must be differentiated from other presentations of myelopathy and may be the first presentation of relapsing ADS such as neuromyelitis optica (NMO) or multiple sclerosis (MS). The tenets of the diagnostic criteria for ATM established by the Transverse Myelitis Consortium Working Group can generally be applied in children; however, a clear sensory level may not be evident in some. MRI lesions are often centrally located with high T2 signal intensity involving gray and neighboring white matter. Longitudinally extensive ATM occurs in the majority. Asymptomatic lesions on brain MRI are seen in more than one-third and predict MS or NMO. The role of antibodies such as myelin oligodendrocyte glycoprotein in monophasic and relapsing ATM and their significance in therapeutic approaches remain unclear. ATM is a potentially devastating condition with variable outcome and presents significant cumulative demands on health and social care resources. Children generally have a better outcome than adults, with one-half making a complete recovery by 2 years. There is need for standardization of clinical assessment and investigation protocols to enable international collaborative studies to delineate prognostic factors for disability and relapse. There are no robust controlled trials in children or adults to inform optimal treatment of ATM, with one study currently open to recruitment. This review provides an overview of current knowledge of clinical features, investigative workup, pathogenesis, and management of ATM and suggests future directions. PMID:27572861

  11. Analysis of pomegranate juice components in rat corpora cavernosal relaxation.

    PubMed

    Oztekin, C V; Gur, S; Abdulkadir, N A; Kartal, M; Karabakan, M; Akdemir, A O; Gökkaya, C S; Cetinkaya, M

    2014-01-01

    This study evaluated the action of pomegranate juice (PJ) and its five principal phenolic constituents on rat corpus cavernosum smooth muscle (CCSM). Isometric tension studies were performed after precontraction with phenylephrine in CCSM from rats. Relaxant responses to PJ and its constituents ellagic acid (EA), chlorogenic acid, caffeic acid, cumaric acid and rutin were investigated. PJ and EA caused CCSM relaxations (94.1 ± 3.7 and 51.3 ± 9.9%), while others induced limited relaxant responses. EA response was not inhibited by L-N(G)-nitroarginine methyl ester (100 μM) and 1H-[1,2,4]-oxadiazolo[4,3-a]quinoxalin-1-one (1 μM). Tetraethylammonium (100 μM) and apamin (10 μM) and nifedipine (10 μM) inhibited EA-induced relaxations at 10(-3) M by 84%, 82% and 78%, respectively. Glibenclamide (10 μM) inhibited EA response (97%, 100 μM). PJ-induced relaxation was not altered by several inhibitors. EA was estimated to be responsible for 13.3% of relaxation caused by PJ. Our study demonstrated that PJ and EA-induced marked relaxations in CCSM. The opening of Ca(2+)-activated K+ channels and the inhibition of Ca(2+)-channels regulate the relaxation by EA, but not PJ. EA has a minor contribution to the marked relaxation obtained by PJ, suggesting the presence of other PJ constituents, which induce nitric oxide-independent corporal relaxation. Further studies are needed to examine the potential of PJ in combination with a PDE5 inhibitor in ED.

  12. Syntheses, structures, and 1H, 13C{1H} and 119Sn{1H} NMR chemical shifts of a family of trimethyltin alkoxide, amide, halide and cyclopentadienyl compounds

    DOE PAGES

    Lichtscheidl, Alejandro G.; Janicke, Michael T.; Scott, Brian L.; Nelson, Andrew T.; Kiplinger, Jaqueline L.

    2015-08-21

    The synthesis and full characterization, including Nuclear Magnetic Resonance (NMR) data (1H, 13C{1H} and 119Sn{1H}), for a series of Me3SnX (X = O-2,6-tBu2C6H3 (1), (Me3Sn)N(2,6-iPr2C6H3) (3), NH-2,4,6-tBu3C6H2 (4), N(SiMe3)2 (5), NEt2, C5Me5 (6), Cl, Br, I, and SnMe3) compounds in benzene-d6, toluene-d8, dichloromethane-d2, chloroform-d1, acetonitrile-d3, and tetrahydrofuran-d8 are reported. The X-ray crystal structures of Me3Sn(O-2,6-tBu2C6H3) (1), Me3Sn(O-2,6-iPr2C6H3) (2), and (Me3Sn)(NH-2,4,6-tBu3C6H2) (4) are also presented. As a result, these compiled data complement existing literature data and ease the characterization of these compounds by routine NMR experiments.

  13. The origin of biexponential T2 relaxation in muscle water

    NASA Technical Reports Server (NTRS)

    Cole, W. C.; LeBlanc, A. D.; Jhingran, S. G.

    1993-01-01

    Two theories have been proposed to explain the multiexponential transverse relaxation of muscle water protons: "anatomical" and "chemical" compartmentation. In an attempt to obtain evidence to support one or the other of these two theories, interstitial and intracellular macromolecular preparations were studied and compared with rat muscle tissue by proton NMR transverse relaxation (T2) measurements. All macromolecule preparations displayed monoexponential T2 decay. Membrane alteration with DMSO/glycerin did not eliminate the biexponential T2 decay of muscle tissue. Maceration converted biexponential T2 decay of muscle tissue to single exponential decay. It is concluded that the observed two component exponential T2 decay of muscle represents anatomical compartmentation of tissue water, probably intracellular versus extracellular.

  14. Sensitivity of proton NMR relaxation times in a HTPB based polyurethane elastomer to thermo-oxidative aging.

    SciTech Connect

    Assink, Roger Alan; Mowery, Daniel Michael; Celina, Mathias Christopher

    2004-09-01

    Solid-state {sup 1}H NMR relaxometry studies were conducted on a hydroxy-terminated polybutadiene (HTPB) based polyurethane elastomer thermo-oxidatively aged at 80 C. The {sup 1}H T{sub 1}, T{sub 2}, and T{sub 1{rho}} relaxation times of samples thermally aged for various periods of time were determined as a function of NMR measurement temperature. The response of each measurement was calculated from a best-fit linear function of the relaxation time vs. aging time. It was found that the T{sub 2,H} and T{sub 1{rho},H} relaxation times exhibited the largest response to thermal degradation, whereas T{sub 1,H} showed minimal change. All of the NMR relaxation measurements on solid samples showed significantly less sensitivity to thermal aging than the T{sub 2,H} relaxation times of solvent-swollen samples.

  15. Anomalous D'yakonov-Perel' spin relaxation in semiconductor quantum wells under a strong magnetic field in the Voigt configuration

    NASA Astrophysics Data System (ADS)

    Zhou, Y.; Yu, T.; Wu, M. W.

    2013-06-01

    We report an anomalous scaling of the D’yakonov-Perel’ spin relaxation with the momentum relaxation in semiconductor quantum wells under a strong magnetic field in the Voigt configuration. We focus on the case in which the external magnetic field is perpendicular to the spin-orbit-coupling-induced effective magnetic field and its magnitude is much larger than the latter one. It is found that the longitudinal spin relaxation time is proportional to the momentum relaxation time even in the strong-scattering limit, indicating that the D’yakonov-Perel’ spin relaxation demonstrates Elliott-Yafet-like behavior. Moreover, the transverse spin relaxation time is proportional (inversely proportional) to the momentum relaxation time in the strong- (weak-) scattering limit, both in the opposite trends against the well-established conventional D’yakonov-Perel’ spin relaxation behaviors. We further demonstrate that all the above anomalous scaling relations come from the unique form of the effective inhomogeneous broadening.

  16. General formulation of transverse hydrodynamics

    SciTech Connect

    Ryblewski, Radoslaw; Florkowski, Wojciech

    2008-06-15

    General formulation of hydrodynamics describing transversally thermalized matter created at the early stages of ultrarelativistic heavy-ion collisions is presented. Similarities and differences with the standard three-dimensionally thermalized relativistic hydrodynamics are discussed. The role of the conservation laws as well as the thermodynamic consistency of two-dimensional thermodynamic variables characterizing transversally thermalized matter is emphasized.

  17. 1H NMR and Rheological Studies of the Calcium Induced Gelation Process in Aqueous Low Methoxyl Pectin Solutions

    NASA Astrophysics Data System (ADS)

    Dobies, M.; Kuśmia, S.; Jurga, S.

    2006-07-01

    The 1H NMR relaxometry in combination with water proton spin-spin relaxation time measurements and rheometry have been applied to study the ionic gelation of 1% w/w aqueous low methoxyl pectin solution induced by divalent Ca2+ cations from a calcium chloride solution. The model-free approach to the analysis of 1H NMR relaxometry data has been used to separate the information on the static (β) and dynamic (<τ_c>) behaviour of the systems tested. The 1H NMR results confirm that the average mobility of both water and the pectin molecules is largely dependent on the concentration of the cross-linking agent. The character of this dependency (β,<τc> and T2 vs. CaCl2 concentration) is consistent with the two-stage gelation process of low methoxyl pectin, in which the formation of strongly linked dimer associations (in the range of 0-2.5 mM CaCl2) is followed by the appearance of weak inter-dimer aggregations (for CaCl2≥ 3.5 mM). The presence of the weak gel structure for the sample with 3.5 mM CaCl2 has been confirmed by rheological measurements. Apart from that, the T1 and T2 relaxation times have been found to be highly sensitive to the syneresis phenomenon, which can be useful to monitor the low methoxyl pectin gel network stability.

  18. Relaxation: mapping an uncharted world.

    PubMed

    Smith, J C; Amutio, A; Anderson, J P; Aria, L A

    1996-03-01

    Nine hundred and forty practitioners of massage, abbreviated progressive muscle relaxation (PMR), yoga stretching, breathing, imagery meditation, and various combination treatments described their technique experiences on an 82-item wordlist. Factor analysis yielded 10 interpretable relaxation categories: Joyful Affects and Appraisals (Joyful), Distant, Calm, Aware, Prayerful, Accepted, Untroubled, Limp, Silent, and Mystery The relaxation response and cognitive/somatic specificity models predict Calm and Limp, which account for only 5.5% of the variance of relaxation experience. Unlike much of previous relaxation research, we found important technique differences. PMR and massage are associated with Distant and Limp; yoga stretching, breathing, and meditation with Aware; meditation with Prayerful and all techniques except PMR with Joyful. Results are consistent with cognitive-behavioral relaxation theory and have implications for relaxation theory, treatment, training, assessment, and research. We close with a revised model of relaxation that posits three global dimensions; tension-relief, passive disengagement, and passive engagement.

  19. Hair Dye and Hair Relaxers

    MedlinePlus

    ... For Consumers Consumer Information by Audience For Women Hair Dye and Hair Relaxers Share Tweet Linkedin Pin it More sharing ... products. If you have a bad reaction to hair dyes and relaxers, you should: Stop using the ...

  20. Effect of Exercise on the Creatine Resonances in 1H MR Spectra of Human Skeletal Muscle

    NASA Astrophysics Data System (ADS)

    Kreis, R.; Jung, B.; Slotboom, J.; Felblinger, J.; Boesch, C.

    1999-04-01

    1H MR spectra of human muscles were recorded before, during, and after fatiguing exercise. In contrast to expectations, it was found that the spectral contributions of creatine/phosphocreatine (Cr/PCr) were subject to change as a function of exercise. In particular, the dipolar-coupled methylene protons of Cr/PCr were found to be reduced in intensity in proportion to the co-registered PCr levels. Recovery after exercise and behavior under ischemic conditions provide further evidence to suggest that the contributions of the CH2protons of Cr/PCr to1H MR spectra of human musclein vivoreflect PCr rather than Cr levels. Variation of experimental parameters showed that this effect is not due to a trivial change in relaxation times. At present it can only be speculated about why the Cr resonances have reduced NMR visibility. If temporary binding to macromolecules should be involved, the free Cr concentration-important for equilibrium calculations of the creatine kinase reaction-might be different from what was previously assumed.

  1. Low resolution 1H NMR assignment of proton populations in pound cake and its polymeric ingredients.

    PubMed

    Luyts, A; Wilderjans, E; Waterschoot, J; Van Haesendonck, I; Brijs, K; Courtin, C M; Hills, B; Delcour, J A

    2013-08-15

    Based on a model system approach, five different proton populations were distinguished in pound cake crumb using one dimensional low resolution (1)H NMR spectroscopy. In free induction decay (FID) measurements, proton populations were assigned to (i) non-exchanging CH protons of crystalline starch, proteins and crystalline fat and (ii) non-exchanging CH protons of amorphous starch and gluten, which are in little contact with water. In Carr-Purcell-Meiboom-Gill (CPMG) measurements, three proton populations were distinguished. The CPMG population with the lowest mobility and the FID population with the highest mobility represent the same proton population. The two CPMG proton populations with the highest mobility were assigned to exchanging protons (i.e., protons of water, starch, gluten, egg proteins and sugar) and protons of lipids (i.e., protons of egg yolk lipids and amorphous lipid fraction of margarine) respectively. Based on their spin-lattice relaxation times (T1), two dimensional (1)H NMR spectroscopy further resolved the two proton populations with the highest mobility into three and two proton populations, respectively. PMID:23561087

  2. Low resolution 1H NMR assignment of proton populations in pound cake and its polymeric ingredients.

    PubMed

    Luyts, A; Wilderjans, E; Waterschoot, J; Van Haesendonck, I; Brijs, K; Courtin, C M; Hills, B; Delcour, J A

    2013-08-15

    Based on a model system approach, five different proton populations were distinguished in pound cake crumb using one dimensional low resolution (1)H NMR spectroscopy. In free induction decay (FID) measurements, proton populations were assigned to (i) non-exchanging CH protons of crystalline starch, proteins and crystalline fat and (ii) non-exchanging CH protons of amorphous starch and gluten, which are in little contact with water. In Carr-Purcell-Meiboom-Gill (CPMG) measurements, three proton populations were distinguished. The CPMG population with the lowest mobility and the FID population with the highest mobility represent the same proton population. The two CPMG proton populations with the highest mobility were assigned to exchanging protons (i.e., protons of water, starch, gluten, egg proteins and sugar) and protons of lipids (i.e., protons of egg yolk lipids and amorphous lipid fraction of margarine) respectively. Based on their spin-lattice relaxation times (T1), two dimensional (1)H NMR spectroscopy further resolved the two proton populations with the highest mobility into three and two proton populations, respectively.

  3. Novel 1H low field nuclear magnetic resonance applications for the field of biodiesel

    PubMed Central

    2013-01-01

    Background Biodiesel production has increased dramatically over the last decade, raising the need for new rapid and non-destructive analytical tools and technologies. 1H Low Field Nuclear Magnetic Resonance (LF-NMR) applications, which offer great potential to the field of biodiesel, have been developed by the Phyto Lipid Biotechnology Lab research team in the last few years. Results Supervised and un-supervised chemometric tools are suggested for screening new alternative biodiesel feedstocks according to oil content and viscosity. The tools allowed assignment into viscosity groups of biodiesel-petrodiesel samples whose viscosity is unknown, and uncovered biodiesel samples that have residues of unreacted acylglycerol and/or methanol, and poorly separated and cleaned glycerol and water. In the case of composite materials, relaxation time distribution, and cross-correlation methods were successfully applied to differentiate components. Continuous distributed methods were also applied to calculate the yield of the transesterification reaction, and thus monitor the progress of the common and in-situ transesterification reactions, offering a tool for optimization of reaction parameters. Conclusions Comprehensive applied tools are detailed for the characterization of new alternative biodiesel resources in their whole conformation, monitoring of the biodiesel transesterification reaction, and quality evaluation of the final product, using a non-invasive and non-destructive technology that is new to the biodiesel research area. A new integrated computational-experimental approach for analysis of 1H LF-NMR relaxometry data is also presented, suggesting improved solution stability and peak resolution. PMID:23590829

  4. Diffusion-relaxed waveguide N[sub 2] lasers

    SciTech Connect

    Kukhlevsky, S.V.; Kozma, L. . Dept. of Physics)

    1993-10-01

    A small-bore diffusion relaxed N[sub 2]-laser (P < 200 Torr) with longitudinal and transverse excitation in single- and multichannel discharge configurations is developed. The authors show that the maximum repetition rate and specific average power of the laser are increased with the decrease of the characteristic transverse dimension of the discharge channel. An 8-kHz repetition rate and average power of 6.4 mW are obtained in very compact laser structure. A specific average power of about 160 mW/cm[sup 3] is achieved, that is a few times higher than that extracted from large-bore plasma tubes. The laser with transverse excitation produces 30-kW pulses at 500 Hz. The waveguide effect in the laser channel and its influence on the spatial distribution and coherence of the laser radiation are also studied.

  5. Relaxation phenomena in disordered systems

    NASA Astrophysics Data System (ADS)

    Sciortino, F.; Tartaglia, P.

    1997-02-01

    In this article we discuss how the assumptions of self-similarity imposed on the distribution of independently relaxing modes, as well as on their amplitude and characteristic times, manifest in the global relaxation phenomena. We also review recent applications of such approach to the description of relaxation phenomena in microemulsions and molecular glasses.

  6. A Comparison of Relaxation Strategies.

    ERIC Educational Resources Information Center

    Matthews, Doris B.

    Some researchers argue that all relaxation techniques produce a single relaxation response while others support a specific-effects hypothesis which suggests that progressive relaxation affects the musculoskeletal system and that guided imagery affects cognitive changes. Autogenics is considered a technique which is both somatic and cognitive. This…

  7. Electron spin relaxation in carbon nanotubes: Dyakonov-Perel mechanism

    NASA Astrophysics Data System (ADS)

    Semenov, Yuriy; Zavada, John; Kim, Ki Wook

    2010-03-01

    The long standing problem of unaccountable short spin relaxation in carbon nanotubes (CNT) meets a disclosure in terms of curvature-mediated spin-orbital interaction that leads to spin fluctuating precession analogous to Dyakonov-Perel mechanism. Strong anisotropy imposed by arbitrary directed magnetic field has been taken into account in terms of extended Bloch equations. Especially, stationary spin current through CNT can be controlled by spin-flip processes with relaxation time as less as 150 ps, the rate of transversal polarization (i.e. decoherence) runs up to 1/(70 ps) at room temperature while spin interference of the electrons related to different valleys can be responsible for shorter spin dephasing. Dependencies of spin-relaxation parameters on magnetic field strength and orientation, CNT curvature and chirality have been analyzed.

  8. Kinesthetic Transverse Wave Demonstration

    NASA Astrophysics Data System (ADS)

    Pantidos, Panagiotis; Patapis, Stamatis

    2005-09-01

    This is a variation on the String and Sticky Tape demonstration "The Wave Game," suggested by Ron Edge. A group of students stand side by side, each one holding a card chest high with both hands. The teacher cues the first student to begin raising and lowering his card. When he starts lowering his card, the next student begins to raise his. As succeeding students move their cards up and down, a wave such as that shown in the figure is produced. To facilitate the process, students' motions were synchronized with the ticks of a metronome (without such synchronization it was nearly impossible to generate a satisfactory wave). Our waves typically had a frequency of about 1 Hz and a wavelength of around 3 m. We videotaped the activity so that the students could analyze the motions. The (17-year-old) students had not received any prior instruction regarding wave motion and did not know beforehand the nature of the exercise they were about to carry out. During the activity they were asked what a transverse wave is. Most of them quickly realized, without teacher input, that while the wave propagated horizontally, the only motion of the transmitting medium (them) was vertical. They located the equilibrium points of the oscillations, the crests and troughs of the waves, and identified the wavelength. The teacher defined for them the period of the oscillations of the motion of a card to be the total time for one cycle. The students measured this time and then several asserted that it was the same as the wave period. Knowing the length of the waves and the number of waves per second, the next step can easily be to find the wave speed.

  9. 27Al-->1H cross-polarization in aluminosilicates.

    PubMed

    Kolodziejski, W; Corma, A

    1994-06-01

    Solid-state nuclear magnetic resonance (NMR) cross-polarization (CP) from 27Al to 1H was set on kaolinite, verified by a variable-contact time experiment and applied to ultrastable zeolite Y. The technique is useful for the selective NMR observation of AlOH sites in aluminosilicates, especially those from extraframework species in zeolites.

  10. Nuclear receptor NR1H3 in familial multiple sclerosis

    PubMed Central

    Wang, Zhe; Sadovnick, A. Dessa; Traboulsee, Anthony L.; Ross, Jay P.; Bernales, Cecily Q.; Encarnacion, Mary; Yee, Irene M.; de Lemos, Madonna; Greenwood, Talitha; Lee, Joshua D.; Wright, Galen; Ross, Colin J.; Zhang, Si; Song, Weihong; Vilariño-Güell, Carles

    2016-01-01

    SUMMARY Multiple sclerosis (MS) is an inflammatory disease characterized by myelin loss and neuronal dysfunction. Despite the aggregation observed in some families, pathogenic mutations have remained elusive. In this study we describe the identification of NR1H3 p.Arg415Gln in seven MS patients from two multi-incident families presenting severe and progressive disease, with an average age at onset of 34 years. Additionally, association analysis of common variants in NR1H3 identified rs2279238 conferring a 1.35-fold increased risk of developing progressive MS. The p.Arg415Gln position is highly conserved in orthologs and paralogs, and disrupts NR1H3 heterodimerization and transcriptional activation of target genes. Protein expression analysis revealed that mutant NR1H3 (LXRA) alters gene expression profiles, suggesting a disruption in transcriptional regulation as one of the mechanisms underlying MS pathogenesis. Our study indicates that pharmacological activation of LXRA or its targets may lead to effective treatments for the highly debilitating and currently untreatable progressive phase of MS. PMID:27253448

  11. Transverse Mode Dynamics and Ultrafast Modulation of Vertical-Cavity Surface-Emitting Lasers

    NASA Technical Reports Server (NTRS)

    Ning, Cun-Zheng; Biegel, Bryan A. (Technical Monitor)

    2002-01-01

    We show that multiple transverse mode dynamics of VCSELs (Vertical-Cavity Surface-Emitting Lasers) can be utilized to generate ultrafast intensity modulation at a frequency over 100 GHz, much higher than the relaxation oscillation frequency. Such multimode beating can be greatly enhanced by taking laser output from part of the output facet.

  12. Combined Diffusion Tensor Imaging and Transverse Relaxometry in Early-Onset Bipolar Disorder

    ERIC Educational Resources Information Center

    Gonenc, Atilla; Frazier, Jean A.; Crowley, David J.; Moore, Constance M.

    2010-01-01

    Objective: Transverse relaxation time (T2) imaging provides the opportunity to examine membrane fluidity, which can affect a number of cellular functions. The objective of the present work was to examine T2 abnormalities in children with unmodified DSM-IV-TR bipolar disorder (BD) in bilateral cingulate-paracingulate (CPC) white matter. Method: A…

  13. Relaxation Dispersion in MRI Induced by Fictitious Magnetic Fields

    PubMed Central

    Liimatainen, Timo; Mangia, Silvia; Ling, Wen; Ellermann, Jutta; Sorce, Dennis J.; Garwood, Michael; Michaeli, Shalom

    2011-01-01

    A new method entitled Relaxation Along a Fictitious Field (RAFF) was recently introduced for investigating relaxations in rotating frames of rank ≥ 3. RAFF generates a fictitious field (E) by applying frequency-swept pulses with sine and cosine amplitude and frequency modulation operating in a sub-adiabatic regime. In the present work, MRI contrast is created by varying the orientation of E, i.e. the angle ε between E and the z″ axis of the second rotating frame. When ε > 45°, the amplitude of the fictitious field E generated during RAFF is significantly larger than the RF field amplitude used for transmitting the sine/cosine pulses. Relaxation during RAFF was investigated using an invariant-trajectory approach and the Bloch-McConnell formalism. Dipole-dipole interactions between identical (like) spins and anisochronous exchange (e.g., exchange between spins with different chemical shifts) in the fast exchange regime were considered. Experimental verifications were performed in vivo in human and mouse brain. Theoretical and experimental results demonstrated that changes in ε induced a dispersion of the relaxation rate constants. The fastest relaxation was achieved at ε ≈ 56°, where the averaged contributions from transverse components during the pulse are maximal and the contribution from longitudinal components are minimal. RAFF relaxation dispersion was compared with the relaxation dispersion achieved with off-resonance spin lock T1ρ experiments. As compared with the off-resonance spin lock T1ρ method, a slower rotating frame relaxation rate was observed with RAFF, which under certain experimental conditions is desirable. PMID:21334231

  14. Transverse Momentum Fluctuations at RHIC

    NASA Astrophysics Data System (ADS)

    Gavin, Sean; Abdel-Aziz, Mohamed

    2004-10-01

    PHENIX and STAR data in Au+Au collisions at RHIC show that transverse momentum fluctuations increase as centrality increases. The approach to local thermal equilibrium can explain the similar centrality dependence of the average transverse momentum and its fluctuations [1]. Alternatively, this dependence can be attributed to jet effects, although the mechanism has not been spelled out in the literature [2]. Certainly both mechanisms play a role at some level. We review the nonequilibrium description of parton thermalization in [1]. We then extend the formulation to account for contributions to fluctuations from the energy loss of the high transverse momentum particles. Calculations are then compared to the measured average transverse momentum and its fluctuations. We then discuss how correlation function measurements may distinguish these effects. [1] Sean Gavin, Phys.Rev.Lett. 92 (2004) 162301. [2] S. S. Adler et al. [PHENIX Collaboration], arXiv:nucl-ex/0310005.

  15. New construction for transversal design.

    PubMed

    Du, Ding-Zhu; Hwang, F K; Wu, Weili; Znati, Taieb

    2006-05-01

    The study of gene functions requires the development of a DNA library of high quality through much of testing and screening. Pooling design is a mathematical tool to reduce the number of tests for DNA library screening. The transversal design is a special type of pooling design, which is good in implementation. In this paper, we present a new construction for transversal designs. We will also extend our construction to the error-tolerant case.

  16. Dynamic nuclear polarization-enhanced 1H-13C double resonance NMR in static samples below 20 K

    NASA Astrophysics Data System (ADS)

    Potapov, Alexey; Thurber, Kent R.; Yau, Wai-Ming; Tycko, Robert

    2012-08-01

    We demonstrate the feasibility of one-dimensional and two-dimensional 1H-13C double resonance NMR experiments with dynamic nuclear polarization (DNP) at 9.4 T and temperatures below 20 K, including both 1H-13C cross-polarization and 1H decoupling, and discuss the effects of polarizing agent type, polarizing agent concentration, temperature, and solvent deuteration. We describe a two-channel low-temperature DNP/NMR probe, capable of carrying the radio-frequency power load required for 1H-13C cross-polarization and high-power proton decoupling. Experiments at 8 K and 16 K reveal a significant T2 relaxation of 13C, induced by electron spin flips. Carr-Purcell experiments and numerical simulations of Carr-Purcell dephasing curves allow us to determine the effective correlation time of electron flips under our experimental conditions. The dependence of the DNP signal enhancement on electron spin concentration shows a maximum near 80 mM. Although no significant difference in the absolute DNP enhancements for triradical (DOTOPA-TEMPO) and biradical (TOTAPOL) dopants was found, the triradical produced greater DNP build-up rates, which are advantageous for DNP experiments. Additionally the feasibility of structural measurements on 13C-labeled biomolecules was demonstrated with a two-dimensional 13C-13C exchange spectrum of selectively 13C-labeled β-amyloid fibrils.

  17. Nuclear magnetic relaxation studies of semiconductor nanocrystals and solids

    SciTech Connect

    Sachleben, J. R.

    1993-09-01

    Semiconductor nanocrystals, small biomolecules, and {sup 13}C enriched solids were studied through the relaxation in NMR spectra. Surface structure of semiconductor nanocrystals (CdS) was deduced from high resolution {sup 1}H and {sup 13}C liquid state spectra of thiophenol ligands on the nanocrystal surfaces. The surface coverage by thiophenol was found to be low, being 5.6 and 26% for nanocrystal radii of 11.8 and 19.2 {angstrom}. Internal motion is estimated to be slow with a correlation time > 10{sup {minus}8} s{sup {minus}1}. The surface thiophenol ligands react to form a dithiophenol when the nanocrystals were subjected to O{sub 2} and ultraviolet. A method for measuring {sup 14}N-{sup 1}H J-couplings is demonstrated on pyridine and the peptide oxytocin; selective 2D T{sub 1} and T{sub 2} experiments are presented for measuring relaxation times in crowded spectra with overlapping peaks in 1D, but relaxation effects interfere. Possibility of carbon-carbon cross relaxation in {sup 13}C enriched solids is demonstrated by experiments on zinc acetate and L-alanine.

  18. TRANSVERSE OSCILLATIONS IN CHROMOSPHERIC MOTTLES

    SciTech Connect

    Kuridze, D.; Mathioudakis, M.; Jess, D. B.; Keenan, F. P.; Morton, R. J.; Erdelyi, R.; Dorrian, G. D.

    2012-05-01

    A number of recent investigations have revealed that transverse waves are ubiquitous in the solar chromosphere. The vast majority of these have been reported in limb spicules and active region fibrils. We investigate long-lived, quiet-Sun, on-disk features such as chromospheric mottles (jet-like features located at the boundaries of supergranular cells) and their transverse motions. The observations were obtained with the Rapid Oscillations in the Solar Atmosphere instrument at the Dunn Solar Telescope. The data set is comprised of simultaneous imaging in the H{alpha} core, Ca II K, and G band of an on-disk quiet-Sun region. Time-distance techniques are used to study the characteristics of the transverse oscillations. We detect over 40 transverse oscillations in both bright and dark mottles, with periods ranging from 70 to 280 s, with the most frequent occurrence at {approx}165 s. The velocity amplitudes and transverse displacements exhibit characteristics similar to limb spicules. Neighboring mottles oscillating in-phase are also observed. The transverse oscillations of individual mottles are interpreted in terms of magnetohydrodynamic kink waves. Their estimated periods and damping times are consistent with phase mixing and resonant mode conversion.

  19. Progressive muscle relaxation, yoga stretching, and ABC relaxation theory.

    PubMed

    Ghoncheh, Shahyad; Smith, Jonathan C

    2004-01-01

    This study compared the psychological effects of progressive muscle relaxation (PMR) and yoga stretching (hatha) exercises. Forty participants were randomly divided into two groups and taught PMR or yoga stretching exercises. Both groups practiced once a week for five weeks and were given the Smith Relaxation States Inventory before and after each session. As hypothesized, practitioners of PMR displayed higher levels of relaxation states (R-States) Physical Relaxation and Disengagement at Week 4 and higher levels of Mental Quiet and Joy as a posttraining aftereffect at Week 5. Contrary to what was hypothesized, groups did not display different levels of R-States Energized or Aware. Results suggest the value of supplementing traditional somatic conceptualizations of relaxation with the psychological approach embodied in ABC relaxation theory. Clinical and research implications are discussed.

  20. Quantitative produced water analysis using mobile 1H NMR

    NASA Astrophysics Data System (ADS)

    Wagner, Lisabeth; Kalli, Chris; Fridjonsson, Einar O.; May, Eric F.; Stanwix, Paul L.; Graham, Brendan F.; Carroll, Matthew R. J.; Johns, Michael L.

    2016-10-01

    Measurement of oil contamination of produced water is required in the oil and gas industry to the (ppm) level prior to discharge in order to meet typical environmental legislative requirements. Here we present the use of compact, mobile 1H nuclear magnetic resonance (NMR) spectroscopy, in combination with solid phase extraction (SPE), to meet this metrology need. The NMR hardware employed featured a sufficiently homogeneous magnetic field, such that chemical shift differences could be used to unambiguously differentiate, and hence quantitatively detect, the required oil and solvent NMR signals. A solvent system consisting of 1% v/v chloroform in tetrachloroethylene was deployed, this provided a comparable 1H NMR signal intensity for the oil and the solvent (chloroform) and hence an internal reference 1H signal from the chloroform resulting in the measurement being effectively self-calibrating. The measurement process was applied to water contaminated with hexane or crude oil over the range 1-30 ppm. The results were validated against known solubility limits as well as infrared analysis and gas chromatography.

  1. Continuum elastic theory of adsorbate vibrational relaxation

    NASA Astrophysics Data System (ADS)

    Lewis, Steven P.; Pykhtin, M. V.; Mele, E. J.; Rappe, Andrew M.

    1998-01-01

    An analytical theory is presented for the damping of low-frequency adsorbate vibrations via resonant coupling to the substrate phonons. The system is treated classically, with the substrate modeled as a semi-infinite elastic continuum and the adsorbate overlayer modeled as an array of point masses connected to the surface by harmonic springs. The theory provides a simple expression for the relaxation rate in terms of fundamental parameters of the system: γ=mω¯02/AcρcT, where m is the adsorbate mass, ω¯0 is the measured frequency, Ac is the overlayer unit-cell area, and ρ and cT are the substrate mass density and transverse speed of sound, respectively. This expression is strongly coverage dependent, and predicts relaxation rates in excellent quantitative agreement with available experiments. For a half-monolayer of carbon monoxide on the copper (100) surface, the predicted damping rate of in-plane frustrated translations is 0.50×1012s-1, as compared to the experimental value of (0.43±0.07)×1012s-1. Furthermore it is shown that, for all coverages presently accessible to experiment, adsorbate motions exhibit collective effects which cannot be treated as stemming from isolated oscillators.

  2. Wall region of a relaxing three-dimensional incompressible turbulent boundary layer

    NASA Technical Reports Server (NTRS)

    Hebbar, K. S.; Melnik, W. L.

    1978-01-01

    A three-dimensional turbulent boundary layer relaxing behind a transverse hump (shaped as a 30-deg swept 5-ft chord wing-type model) was studied in a low-speed wind tunnel. Data obtained with hot-wire probes showed that the apparent dimensionless velocity profiles in the viscous sublayer prevail universally; evidence for wall similarity in the relaxing flow field was confirmed in the form of a log law. An unusual region of slightly decreasing cross-flow angle was found in collateral regions, and a near-wall noncollateral flow was posited. Streamwise relaxation of the mean flow field was also investigated.

  3. Mechanisms of Gadographene-Mediated Proton Spin Relaxation

    PubMed Central

    Hung, Andy H.; Duch, Matthew C.; Parigi, Giacomo; Rotz, Matthew W.; Manus, Lisa M.; Mastarone, Daniel J.; Dam, Kevin T.; Gits, Colton C.; MacRenaris, Keith W.; Luchinat, Claudio; Hersam, Mark C.; Meade, Thomas J.

    2013-01-01

    Gd(III) associated with carbon nanomaterials relaxes water proton spins at an effectiveness that approaches or exceeds the theoretical limit for a single bound water molecule. These Gd(III)-labeled materials represent a potential breakthrough in sensitivity for Gd(III)-based contrast agents used for magnetic resonance imaging (MRI). However, their mechanism of action remains unclear. A gadographene library encompassing GdCl3, two different Gd(III)-complexes, graphene oxide (GO), and graphene suspended by two different surfactants and subjected to varying degrees of sonication was prepared and characterized for their relaxometric properties. Gadographene was found to perform comparably to other Gd(III)-carbon nanomaterials; its longitudinal (r1) and transverse (r2) relaxivity is modulated between 12–85 mM−1s−1 and 24–115 mM−1s−1, respectively, depending on the Gd(III)-carbon backbone combination. The unusually large relaxivity and its variance can be understood under the modified Florence model incorporating the Lipari-Szabo approach. Changes in hydration number (q), water residence time (τM), molecular tumbling rate (τR), and local motion (τfast) sufficiently explain most of the measured relaxivities. Furthermore, results implicated the coupling between graphene and Gd(III) as a minor contributor to proton spin relaxation. PMID:24298299

  4. Evaluation of brain edema using magnetic resonance proton relaxation times

    SciTech Connect

    Fu, Y.; Tanaka, K.; Nishimura, S. )

    1990-01-01

    Experimental and clinical studies on the evaluation of water content in cases of brain edema were performed in vivo, using MR proton relaxation times (longitudinal relaxation time, T1; transverse relaxation time, T2). Brain edema was produced in the white matter of cats by the direct infusion method. The correlations between proton relaxation times obtained from MR images and the water content of white matter were studied both in autoserum-infused cats and in saline-infused cats. The correlations between T1 as well as T2 and the water content in human vasogenic brain edema were also examined and compared with the data obtained from the serum group. T1 and T2 showed good correlations with the water content of white matter not only in the experimental animals but also in the clinical cases. The quality of the edema fluid did not influence relaxation time and T1 seemed to represent almost solely the water content of the tissue. T2, however, was affected by the nature of existence of water and was more sensitive than T1 in detecting extravasated edema fluid. It seems feasible therefore to evaluate the water content of brain edema on the basis of T1 values.

  5. Proton-detected 3D 1H/13C/1H correlation experiment for structural analysis in rigid solids under ultrafast-MAS above 60 kHz

    NASA Astrophysics Data System (ADS)

    Zhang, Rongchun; Nishiyama, Yusuke; Ramamoorthy, Ayyalusamy

    2015-10-01

    A proton-detected 3D 1H/13C/1H chemical shift correlation experiment is proposed for the assignment of chemical shift resonances, identification of 13C-1H connectivities, and proximities of 13C-1H and 1H-1H nuclei under ultrafast magic-angle-spinning (ultrafast-MAS) conditions. Ultrafast-MAS is used to suppress all anisotropic interactions including 1H-1H dipolar couplings, while the finite-pulse radio frequency driven dipolar recoupling (fp-RFDR) pulse sequence is used to recouple dipolar couplings among protons and the insensitive nuclei enhanced by polarization transfer technique is used to transfer magnetization between heteronuclear spins. The 3D experiment eliminates signals from non-carbon-bonded protons and non-proton-bonded carbons to enhance spectral resolution. The 2D (F1/F3) 1H/1H and 2D 13C/1H (F2/F3) chemical shift correlation spectra extracted from the 3D spectrum enable the identification of 1H-1H proximity and 13C-1H connectivity. In addition, the 2D (F1/F2) 1H/13C chemical shift correlation spectrum, incorporated with proton magnetization exchange via the fp-RFDR recoupling of 1H-1H dipolar couplings, enables the measurement of proximities between 13C and even the remote non-carbon-bonded protons. The 3D experiment also gives three-spin proximities of 1H-1H-13C chains. Experimental results obtained from powder samples of L-alanine and L-histidine ṡ H2O ṡ HCl demonstrate the efficiency of the 3D experiment.

  6. Proton-detected 3D (1)H/(13)C/(1)H correlation experiment for structural analysis in rigid solids under ultrafast-MAS above 60 kHz.

    PubMed

    Zhang, Rongchun; Nishiyama, Yusuke; Ramamoorthy, Ayyalusamy

    2015-10-28

    A proton-detected 3D (1)H/(13)C/(1)H chemical shift correlation experiment is proposed for the assignment of chemical shift resonances, identification of (13)C-(1)H connectivities, and proximities of (13)C-(1)H and (1)H-(1)H nuclei under ultrafast magic-angle-spinning (ultrafast-MAS) conditions. Ultrafast-MAS is used to suppress all anisotropic interactions including (1)H-(1)H dipolar couplings, while the finite-pulse radio frequency driven dipolar recoupling (fp-RFDR) pulse sequence is used to recouple dipolar couplings among protons and the insensitive nuclei enhanced by polarization transfer technique is used to transfer magnetization between heteronuclear spins. The 3D experiment eliminates signals from non-carbon-bonded protons and non-proton-bonded carbons to enhance spectral resolution. The 2D (F1/F3) (1)H/(1)H and 2D (13)C/(1)H (F2/F3) chemical shift correlation spectra extracted from the 3D spectrum enable the identification of (1)H-(1)H proximity and (13)C-(1)H connectivity. In addition, the 2D (F1/F2) (1)H/(13)C chemical shift correlation spectrum, incorporated with proton magnetization exchange via the fp-RFDR recoupling of (1)H-(1)H dipolar couplings, enables the measurement of proximities between (13)C and even the remote non-carbon-bonded protons. The 3D experiment also gives three-spin proximities of (1)H-(1)H-(13)C chains. Experimental results obtained from powder samples of L-alanine and L-histidine ⋅ H2O ⋅ HCl demonstrate the efficiency of the 3D experiment.

  7. Sodium-23 magnetic resonance imaging during and after transient cerebral ischemia: multinuclear stroke protocols for double-tuned 23Na/1H resonator systems

    NASA Astrophysics Data System (ADS)

    Wetterling, Friedrich; Ansar, Saema; Handwerker, Eva

    2012-11-01

    A double-tuned 23Na/1H resonator system was developed to record multinuclear MR image data during and after transient cerebral ischemia. 1H-diffusion-, 1H perfusion, 1H T2-, 1H arterial blood flow- and 23Na spin density-weighted images were then acquired at three time points in a rodent stroke model: (I) during 90 min artery occlusion, (II) directly after arterial reperfusion and (III) one day after arterial reperfusion. Normal 23Na was detected in hypoperfused stroke tissue which exhibited a low 1H apparent diffusion coefficient (ADC) and no changes in 1H T2 relaxation time during transient ischemia, while 23Na increased and ADC values recovered to normal values directly after arterial reperfusion. For the first time, a similar imaging protocol was set-up on a clinical 3T MRI site in conjunction with a commercial double-tuned 1H/23Na birdcage resonator avoiding a time-consuming exchange of resonators or MRI systems. Multinuclear 23Na/1H MRI data sets were obtained from one stroke patient during both the acute and non-acute stroke phases with an aquisition time of 22 min. The lesion exhibiting low ADC was found to be larger compared to the lesion with high 23Na at 9 h after symptom onset. It is hoped that the presented pilot data demonstrate that fast multinuclear 23Na/1H MRI preclinical and clinical protocols can enable a better understanding of how temporal and regional MRI parameter changes link to pathophysiological variations in ischemic stroke tissue.

  8. Generalized extended Navier-Stokes theory: multiscale spin relaxation in molecular fluids.

    PubMed

    Hansen, J S

    2013-09-01

    This paper studies the relaxation of the molecular spin angular velocity in the framework of generalized extended Navier-Stokes theory. Using molecular dynamics simulations, it is shown that for uncharged diatomic molecules the relaxation time decreases with increasing molecular moment of inertia per unit mass. In the regime of large moment of inertia the fast relaxation is wave-vector independent and dominated by the coupling between spin and the fluid streaming velocity, whereas for small inertia the relaxation is slow and spin diffusion plays a significant role. The fast wave-vector-independent relaxation is also observed for highly packed systems. The transverse and longitudinal spin modes have, to a good approximation, identical relaxation, indicating that the longitudinal and transverse spin viscosities have same value. The relaxation is also shown to be isomorphic invariant. Finally, the effect of the coupling in the zero frequency and wave-vector limit is quantified by a characteristic length scale; if the system dimension is comparable to this length the coupling must be included into the fluid dynamical description. It is found that the length scale is independent of moment of inertia but dependent on the state point. PMID:24125208

  9. Transverse deformations of extreme horizons

    NASA Astrophysics Data System (ADS)

    Li, Carmen; Lucietti, James

    2016-04-01

    We consider the inverse problem of determining all extreme black hole solutions to the Einstein equations with a prescribed near-horizon geometry. We investigate this problem by considering infinitesimal deformations of the near-horizon geometry along transverse null geodesics. We show that, up to a gauge transformation, the linearised Einstein equations reduce to an elliptic PDE for the extrinsic curvature of a cross-section of the horizon. We deduce that for a given near-horizon geometry there exists a finite dimensional moduli space of infinitesimal transverse deformations. We then establish a uniqueness theorem for transverse deformations of the extreme Kerr horizon. In particular, we prove that the only smooth axisymmetric transverse deformation of the near-horizon geometry of extreme Kerr, such that cross-sections of the horizon are marginally trapped surfaces, corresponds to that of the extreme Kerr black hole. Furthermore, we determine all smooth and biaxisymmetric transverse deformations of the near-horizon geometry of the five-dimensional extreme Myers-Perry black hole with equal angular momenta. We find a three parameter family of solutions such that cross-sections of the horizon are marginally trapped, which is more general than the known black hole solutions. We discuss the possibility that they correspond to new five-dimensional vacuum black holes.

  10. [Death in a relaxation tank].

    PubMed

    Rupp, Wolf; Simon, Karl-Heinz; Bohnert, Michael

    2009-01-01

    Complete relaxation can be achieved by floating in a darkened, sound-proof relaxation tank filled with salinated water kept at body temperature. Under these conditions, meditation exercises up to self-hypnosis may lead to deep relaxation with physical and mental revitalization. A user manipulated his tank, presumably to completely cut off all optical and acoustic stimuli and accidentally also covered the ventilation hole. The man was found dead in his relaxation tank. The findings suggested lack of oxygen as the cause of death.

  11. Topological constraints on magnetic relaxation.

    PubMed

    Yeates, A R; Hornig, G; Wilmot-Smith, A L

    2010-08-20

    The final state of turbulent magnetic relaxation in a reversed field pinch is well explained by Taylor's hypothesis. However, recent resistive-magnetohydrodynamic simulations of the relaxation of braided solar coronal loops have led to relaxed fields far from the Taylor state, despite the conservation of helicity. We point out the existence of an additional topological invariant in any flux tube with a nonzero field: the topological degree of the field line mapping. We conjecture that this constrains the relaxation, explaining why only one of three example simulations reaches the Taylor state. PMID:20868104

  12. Effect of Paramagnetic Ions on NMR Relaxation of Fluids at Solid Surfaces

    PubMed

    Foley; Farooqui; Kleinberg

    1996-11-01

    Proton NMR longitudinal and transverse relaxation times of water-saturated powder packs have been measured. The powders were a series of synthetic calcium silicates with known concentrations of iron or manganese paramagnetic ions. The rate of water proton relaxation has been found to be linearly proportional to the concentration of paramagnetic ion. The constant of proportionality is used to determine the electron relaxation time of ions at the fluid-solid interface. A substantial relaxivity is found in the absence of paramagnetic ions. Thus the oxide surface itself is an unexpectedly good relaxer of fluid-borne nuclear spins. The results answer some long-standing questions connected with the NMR properties of fluid-saturated sedimentary rocks.

  13. In vivo1H NMR spectroscopy of the human brain at 9.4 T: Initial results

    NASA Astrophysics Data System (ADS)

    Deelchand, Dinesh Kumar; Moortele, Pierre-François Van de; Adriany, Gregor; Iltis, Isabelle; Andersen, Peter; Strupp, John P.; Thomas Vaughan, J.; Uğurbil, Kâmil; Henry, Pierre-Gilles

    2010-09-01

    In vivo proton NMR spectroscopy allows non-invasive detection and quantification of a wide range of biochemical compounds in the brain. Higher field strength is generally considered advantageous for spectroscopy due to increased signal-to-noise and increased spectral dispersion. So far 1H NMR spectra have been reported in the human brain up to 7 T. In this study we show that excellent quality short echo time STEAM and LASER 1H NMR spectra can be measured in the human brain at 9.4 T. The information content of the human brain spectra appears very similar to that measured in the past decade in rodent brains at the same field strength, in spite of broader linewidth in human brain. Compared to lower fields, the T1 relaxation times of metabolites were slightly longer while T2 relaxation values of metabolites were shorter (<100 ms) at 9.4 T. The linewidth of the total creatine (tCr) resonance at 3.03 ppm increased linearly with magnetic field (1.35 Hz/T from 1.5 T to 9.4 T), with a minimum achievable tCr linewidth of around 12.5 Hz at 9.4 T. At very high field, B0 microsusceptibility effects are the main contributor to the minimum achievable linewidth.

  14. Dynamic structures of intact chicken erythrocyte chromatins as studied by 1H-31P cross-polarization NMR.

    PubMed Central

    Akutsu, H; Nishimoto, S; Kyogoku, Y

    1994-01-01

    The dynamic properties of DNA in intact chicken erythrocyte cells, nuclei, nondigested chromatins, digested soluble chromatins, H1, H5-depleted soluble chromatins and nucleosome cores were investigated by means of single-pulse and 1H-31P cross-polarization NMR. The temperature dependence of the phosphorus chemical shift anisotropy was identical for the former three in the presence of 3 mM MgCl2, suggesting that the local higher order structure is identical for these chromatins. The intrinsic phosphorus chemical shift anisotropy of the nucleosome cores was -159 ppm. The chemical shift anisotropy of DNA in the chromatins can be further averaged by the motion of the linker DNA. The spin-lattice relaxation time in the rotating frame of the proton spins (T1p) of the nondigested chromatins was measured at various locking fields. The result was analyzed on the assumption of the isotropic motion to get a rough value of the correlation time of the motion efficient for the relaxation, which was eventually ascribed to the segmental motion of the linker DNA with restricted amplitude. The 30 nm filament structure induced by NaCl was shown to be dynamically different from that induced by MgCl2. Side-by-side compaction of 30-nm filaments was suggested to be induced in the MgCl2 concentration range higher than 0.3 mM. Biological significance of the dynamic structure was discussed in connection with the results obtained. PMID:7948693

  15. Relaxation Techniques for Trauma.

    PubMed

    Scotland-Coogan, Diane; Davis, Erin

    2016-01-01

    Physiological symptoms of posttraumatic stress disorder (PTSD) manifest as increased arousal and reactivity seen as anger outburst, irritability, reckless behavior with no concern for consequences, hypervigilance, sleep disturbance, and problems with focus (American Psychiatric Association, 2013 ). In seeking the most beneficial treatment for PTSD, consideration must be given to the anxiety response. Relaxation techniques are shown to help address the physiological manifestations of prolonged stress. The techniques addressed by the authors in this article include mindfulness, deep breathing, yoga, and meditation. By utilizing these techniques traditional therapies can be complemented. In addition, those who are averse to the traditional evidence-based practices or for those who have tried traditional therapies without success; these alternative interventions may assist in lessening physiological manifestations of PTSD. Future research studies assessing the benefits of these treatment modalities are warranted to provide empirical evidence to support the efficacy of these treatments. PMID:27119722

  16. Comet Bursting Through Relaxation

    NASA Astrophysics Data System (ADS)

    Jacobson, Seth A.; Scheeres, D. J.

    2012-10-01

    Comets may be excited and occupy non-principal axis (complex) rotation states for a large fraction of their lifetimes. Many comet nuclei have been identified or are suspected to occupy non-principal axis (complex) rotation [Belton 2005, etc.] as well as have evolving rotation rates [Belton 2011, etc.]. Comet orbits drive these rotation states through cycles of excitation due to surface jets and relaxation due to time variable internal stresses that dissipate energy in the anelastic comet interior. Furthermore, relaxation from complex rotation can increase the loads along the symmetry axis of prolate comets. These loads stretch the body along the symmetry axis and may be the cause of the characteristic ``bowling pin’’ shape and eventually may lead to failure. This is an alternative model for comet bursting. Each cycle deposits only a small amount of energy and stress along the axis, but this process is repeated every orbit during which jets are activated. Our model for the evolution of comet nuclei includes torques due to a number of discrete jets located on the surface based on Neishtadt et al. [2002]. The model also includes internal dissipation using an approach developed by Sharma et al. [2005] and Vokrouhlicky et al. [2009]. These equations are averaged over the instantaneous spin state and the heliocentric orbit so the long-term evolution of the comet can be determined. We determine that even after the inclusion of internal dissipation there still exist non-principal axis equilibrium states for certain jet geometries. For ranges of dissipation factors and jet geometries, prolate comets are found to occupy states that have time variable internal loads over long time periods. These periodic loadings along the symmetry axis may lead to ``necking’’ as the body extends along the axis to release the stress and eventually disruption.

  17. Flutter analysis using transversality theory

    NASA Technical Reports Server (NTRS)

    Afolabi, D.

    1993-01-01

    A new method of calculating flutter boundaries of undamped aeronautical structures is presented. The method is an application of the weak transversality theorem used in catastrophe theory. In the first instance, the flutter problem is cast in matrix form using a frequency domain method, leading to an eigenvalue matrix. The characteristic polynomial resulting from this matrix usually has a smooth dependence on the system's parameters. As these parameters change with operating conditions, certain critical values are reached at which flutter sets in. Our approach is to use the transversality theorem in locating such flutter boundaries using this criterion: at a flutter boundary, the characteristic polynomial does not intersect the axis of the abscissa transversally. Formulas for computing the flutter boundaries and flutter frequencies of structures with two degrees of freedom are presented, and extension to multi-degree of freedom systems is indicated. The formulas have obvious applications in, for instance, problems of panel flutter at supersonic Mach numbers.

  18. Detection of intramyocardial hemorrhage using high-field proton (1H) nuclear magnetic resonance imaging

    SciTech Connect

    Lotan, C.S.; Miller, S.K.; Bouchard, A.; Cranney, G.B.; Reeves, R.C.; Bishop, S.P.; Elgavish, G.A.; Pohost, G.M. )

    1990-07-01

    Proton (1H) nuclear magnetic resonance (NMR) imaging has been used to define zones of myocardial infarction (MI), which appear as areas of relatively increased signal intensity (SI). However, zones of decreased SI have been observed within the areas of infarction and have been postulated to result from intramyocardial hemorrhage. To explore this phenomenon further, ex vivo spin-echo 1H NMR imaging at 1.5 Tesla was performed in 17 dogs after 24 hr (n = 9) and after 72 hr (n = 8) of coronary artery occlusion. In all dogs, a zone of increased SI (118 +/- 9% compared with normal myocardium) was observed in the distribution of the occluded coronary artery. In 12 of the 17 dogs, zones of decreased SI (92 +/- 8% compared with normal) were seen within or around the central zone of increased SI. Gross inspection and histological assessment of sliced myocardium usually disclosed hemorrhage in the regions of decreased SI. In three of the five dogs with no apparent zones of decreased SI on NMR, the infarct was small, and only minor hemorrhage was observed by gross inspection, whereas in the remaining two dogs no hemorrhage was seen. Myocardial flow in the hemorrhagic regions was significantly higher than in the necrotic core (59 +/- 29% vs. 31 +/- 24% compared with control, P less than 0.05). Image-derived calculation of T2 relaxation times in the different infarcted regions revealed a significant shortening of T2 in the infarcted hemorrhagic zones with decreased SI compared with the infarct zones with increased SI (49 +/- 8 msec vs. 66 +/- 8 msec, P less than 0.05).

  19. Muon spin relaxation in spin glass PdMn

    SciTech Connect

    Heffner, R.H.; Leon, M.; Schillaci, M.E.; Dodds, S.A.; Gist, G.A.; MacLaughlin, D.E.; Mydosh, J.A.; Nieuwenhuys, G.J.

    1983-01-01

    Muon spin relaxation (..mu..SR) rates have been measured in transverse, longitudinal, and zero applied field for the spin glass PdMn (7 at. %), and are compared with a previous study of the disordered ferromagnet PdMn (2 at. %). The calculated paramagnetic state transverse field relaxation rate for noninteracting spins is much larger than the observed rate in spin glass PdMn, but is in good agreement with ferromagnetic PdMn. The zero field relaxation rate shows a sharp cusp at T/sub g/=5K. An applied longitudinal field of 5 kG is insufficient to suppress this cusp in spin glss PdMn, but will suppress a similar cusp in ferromagnetic PdMn. Below T/sub g/=5K. An applied longitudinal field of 5 kG is insufficient to suppress this cusp in spin glass PdMn, but will suppress a similar cusp in ferromagnetic PdMn. Below T/sub g/, a distribution of quasistatic local fields is observed in zero field, which has the same temperature dependence for both samples. Comparisons with model calculations are discussed.

  20. Dynamics of phosphate head groups in biomembranes. Comprehensive analysis using phosphorus-31 nuclear magnetic resonance lineshape and relaxation time measurements.

    PubMed Central

    Dufourc, E J; Mayer, C; Stohrer, J; Althoff, G; Kothe, G

    1992-01-01

    Phospholipid head group dynamics have been studied by pulsed phosphorus-31 nuclear magnetic resonance (31P-NMR) of unoriented and macroscopically aligned dimyristoylphosphatidylcholine model membranes in the temperature range, 203-343 K. Lineshapes and echo intensities have been recorded as a function of interpulse delay times, temperature and macroscopic orientation of the bilayer normal with respect to the magnetic field. The dipolar proton-phosphorus (1H-31P) contribution to the transverse relaxation time, T2E, and to lineshapes was eliminated by means of a proton spin-lock sequence. In case of longitudinal spin relaxation, T1Z, the amount of dipolar coupling was evaluated by measuring the maximum nuclear Overhauser enhancement. Hence, the results could be analyzed by considering chemical shift anisotropy as the only relaxation mechanism. The presence of various minima both in T1Z and T2E temperature plots as well as the angular dependence of these relaxation times allowed description of the dynamics of the phosphate head group in the 31P-NMR time window, by three different motional classes, i.e., intramolecular, intermolecular and collective motions. The intramolecular motions consist of two hindered rotations and one free rotation around the bonds linking the phosphate head group to the glycerol backbone. These motions are the fastest in the hierarchy of time with correlation times varying from less than 10(-12) to 10(-6) s in the temperature range investigated. The intermolecular motions are assigned to phospholipid long axis rotation and fluctuation. They have correlation times ranging from 10(-11) s at high temperatures to 10(-3) s at low temperatures. The slowest motion affecting the 31P-NMR observables is assigned to viscoelastic modes, i.e., so called order director fluctuations and is only detected at high temperatures, above the main transition in pulse frequency dependent T2ECP experiments. Comprehensive analysis of the phosphate head group dynamics

  1. The 1H NMR Profile of Healthy Dog Cerebrospinal Fluid

    PubMed Central

    Musteata, Mihai; Nicolescu, Alina; Solcan, Gheorghe; Deleanu, Calin

    2013-01-01

    The availability of data for reference values in cerebrospinal fluid for healthy humans is limited due to obvious practical and ethical issues. The variability of reported values for metabolites in human cerebrospinal fluid is quite large. Dogs present great similarities with humans, including in cases of central nervous system pathologies. The paper presents the first study on healthy dog cerebrospinal fluid metabolomic profile using 1H NMR spectroscopy. A number of 13 metabolites have been identified and quantified from cerebrospinal fluid collected from a group of 10 mix breed healthy dogs. The biological variability as resulting from the relative standard deviation of the physiological concentrations of the identified metabolites had a mean of 18.20% (range between 9.3% and 44.8%). The reported concentrations for metabolites may be used as normal reference values. The homogeneity of the obtained results and the low biologic variability show that the 1H NMR analysis of the dog’s cerebrospinal fluid is reliable in designing and interpreting clinical and therapeutic trials in dogs with central nervous system pathologies. PMID:24376499

  2. 23Na and 1H NMR Microimaging of Intact Plants

    NASA Astrophysics Data System (ADS)

    Olt, Silvia; Krötz, Eva; Komor, Ewald; Rokitta, Markus; Haase, Axel

    2000-06-01

    23Na NMR microimaging is described to map, for the first time, the sodium distribution in living plants. As an example, the response of 6-day-old seedlings of Ricinus communis to exposure to sodium chloride concentrations from 5 to 300 mM was observed in vivo using 23Na as well as 1H NMR microimaging. Experiments were performed at 11.75 T with a double resonant 23Na-1H probehead. The probehead was homebuilt and equipped with a climate chamber. T1 and T2 of 23Na were measured in the cross section of the hypocotyl. Within 85 min 23Na images with an in-plane resolution of 156 × 156 μm were acquired. With this spatial information, the different types of tissue in the hypocotyl can be discerned. The measurement time appears to be short compared to the time scale of sodium uptake and accumulation in the plant so that the kinetics of salt stress can be followed. In conclusion, 23Na NMR microimaging promises great potential for physiological studies of the consequences of salt stress on the macroscopic level and thus may become a unique tool for characterizing plants with respect to salt tolerance and salt sensitivity.

  3. Measuring the Longitudinal NMR Relaxation Rates of Fast Relaxing Nuclei Using a Signal Eliminating Relaxation Filter

    NASA Astrophysics Data System (ADS)

    Hansen, D. Flemming; Led, Jens J.

    2001-08-01

    A new experiment for selective determination of the relaxation rates of fast relaxing NMR signals is presented. The experiment is derived from the conventional inversion recovery experiment by substituting the 180° inversion pulse of this experiment with a signal eliminating relaxation filter (SERF) consisting of three 180° pulses separated by two variable delays, Δ1 and Δ2. The SERF experiment allows a selective suppression of signals with relaxation rates below a given limit while monitoring the relaxation of faster relaxing signals. The experiment was tested on a sample of 20% oxidized plastocyanin from Anabaena variabilis, where the fast exchange of an electron between the reduced (diamagnetic) and the oxidized (paramagnetic) form results in a series of average signals with widely different relaxation rates. To ensure an optimum extraction of information from the experimental data, the relaxation rates were obtained from the SERF experiment by a simultaneous analysis of all the FIDs of the experiment using a fast linear prediction model method developed previously. The reliability of the relaxation rates obtained from the SERF experiment was confirmed by a comparison of the rates with the corresponding rates obtained from a conventional inversion recovery experiment.

  4. Measuring the longitudinal NMR relaxation rates of fast relaxing nuclei using a signal eliminating relaxation filter.

    PubMed

    Hansen, D F; Led, J J

    2001-08-01

    A new experiment for selective determination of the relaxation rates of fast relaxing NMR signals is presented. The experiment is derived from the conventional inversion recovery experiment by substituting the 180 degrees inversion pulse of this experiment with a signal eliminating relaxation filter (SERF) consisting of three 180 degrees pulses separated by two variable delays, Delta1 and Delta2. The SERF experiment allows a selective suppression of signals with relaxation rates below a given limit while monitoring the relaxation of faster relaxing signals. The experiment was tested on a sample of 20% oxidized plastocyanin from Anabaena variabilis, where the fast exchange of an electron between the reduced (diamagnetic) and the oxidized (paramagnetic) form results in a series of average signals with widely different relaxation rates. To ensure an optimum extraction of information from the experimental data, the relaxation rates were obtained from the SERF experiment by a simultaneous analysis of all the FIDs of the experiment using a fast linear prediction model method developed previously. The reliability of the relaxation rates obtained from the SERF experiment was confirmed by a comparison of the rates with the corresponding rates obtained from a conventional inversion recovery experiment.

  5. Dynamics-based selective 2D 1H/1H chemical shift correlation spectroscopy under ultrafast MAS conditions

    PubMed Central

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-01-01

    Dynamics plays important roles in determining the physical, chemical, and functional properties of a variety of chemical and biological materials. However, a material (such as a polymer) generally has mobile and rigid regions in order to have high strength and toughness at the same time. Therefore, it is difficult to measure the role of mobile phase without being affected by the rigid components. Herein, we propose a highly sensitive solid-state NMR approach that utilizes a dipolar-coupling based filter (composed of 12 equally spaced 90° RF pulses) to selectively measure the correlation of 1H chemical shifts from the mobile regions of a material. It is interesting to find that the rotor-synchronized dipolar filter strength decreases with increasing inter-pulse delay between the 90° pulses, whereas the dipolar filter strength increases with increasing inter-pulse delay under static conditions. In this study, we also demonstrate the unique advantages of proton-detection under ultrafast magic-angle-spinning conditions to enhance the spectral resolution and sensitivity for studies on small molecules as well as multi-phase polymers. Our results further demonstrate the use of finite-pulse radio-frequency driven recoupling pulse sequence to efficiently recouple weak proton-proton dipolar couplings in the dynamic regions of a molecule and to facilitate the fast acquisition of 1H/1H correlation spectrum compared to the traditional 2D NOESY (Nuclear Overhauser effect spectroscopy) experiment. We believe that the proposed approach is beneficial to study mobile components in multi-phase systems, such as block copolymers, polymer blends, nanocomposites, heterogeneous amyloid mixture of oligomers and fibers, and other materials. PMID:26026440

  6. Solid state {sup 1}H and {sup 13}C NMR structural investigation of a poly(ethylene oxide) hydrogel

    SciTech Connect

    Badiger, M.V.; Graham, N.B.; Law, R.V.; Snape, C.E.

    1993-12-31

    A cross-linked poly (ethylene oxide)/polyurethane hydrogel cross-linked with 1,2,6 hexane-triol and designated PEG4050/1HT [measured M{sup n} of 4050 for poly (ethylene oxide) glycol (PEG) and a mole ratio of 1:1 for the PEG to the 1,2,6 hexane-triol] has been characterized by high resolution {sup 1}H and {sup 13}C NMR. {sup 1}H thermal (T{sub 1}) and rotating frame (T{sub 1{rho}}) and {sup 13}CT{sub 1} relaxation times were determined for the powdered dry and swollen hydrogel with the standard variants of the cross-polarization pulse sequence which was used in conjunction with magic-angle spinning (MAS). The rotating frame relaxation measurements confirmed that crystalline and amorphous regions were present in the dry hydrogel but showed unabiguously that the crystalline regions are confined to the poly (ethylene oxide) chains, Upon hydration, there is a decrease in the cross polarization efficiency from the enhanced mobility by the poly (ethylene oxide) chains are affected to a much greater extent that the urethane and hexane segments, the characteristic time constant, T{sub CH} increasing by more than order of magnitude compared to no more than a factor of two for the latter. Clearly, the hydration involves hydrogen bonding between the water and principally the oxygens in the poly (ethylene oxide) chains. The {sup 1}H MAS spectra of the dry and hydrated samples confirmed that considerable averaging of the dipolar interactions occurs on hydration to give a well-resolved spectrum.

  7. NMR relaxation studies in doped poly-3-methylthiophene

    NASA Astrophysics Data System (ADS)

    Singh, K. Jugeshwar; Clark, W. G.; Gaidos, G.; Reyes, A. P.; Kuhns, P.; Thompson, J. D.; Menon, R.; Ramesh, K. P.

    2015-05-01

    NMR relaxation rates (1 /T1 ), magnetic susceptibility, and electrical conductivity studies in doped poly-3-methylthiophene are reported in this paper. The magnetic susceptibility data show the contributions from both Pauli and Curie spins, with the size of the Pauli term depending strongly on the doping level. Proton and fluorine NMR relaxation rates have been studied as a function of temperature (3-300 K) and field (for protons at 0.9, 9.0, 16.4, and 23.4 T, and for fluorine at 9.0 T). The temperature dependence of T1 is classified into three regimes: (a) For T <(g μBB /2 kB ) , the relaxation mechanism follows a modified Korringa relation due to electron-electron interactions and disorder. 1H - T1 is due to the electron-nuclear dipolar interaction in addition to the contact term. (b) For the intermediate temperature range (g μBB /2 kB ) relaxation mechanism is via spin diffusion to the paramagnetic centers. (c) In the high-temperature regime and at low Larmor frequency the relaxation follows the modified Bloembergen, Purcell, and Pound model. T1 data analysis has been carried out in light of these models depending upon the temperature and frequency range of study. Fluorine relaxation data have been analyzed and attributed to the P F6 reorientation. The cross relaxation among the 1H and 19F nuclei has been observed in the entire temperature range suggesting the role of magnetic dipolar interaction modulated by the reorientation of the symmetric molecular subgroups. The data analysis shows that the enhancement in the Korringa ratio is greater in a less conducting sample. Intra- and interchain hopping of charge carriers is found to be a dominant relaxation mechanism at low temperature. Frequency dependence of T1-1 on temperature shows that at low temperature [T <(g μBB /2 kB ) ] the system shows three dimensions and changes to quasi one dimension at

  8. Relaxation dynamics in the frustrated Cr9 antiferromagnetic ring probed by NMR

    NASA Astrophysics Data System (ADS)

    Garlatti, E.; Bordignon, S.; Carretta, S.; Allodi, G.; Amoretti, G.; De Renzi, R.; Lascialfari, A.; Furukawa, Y.; Timco, G. A.; Woolfson, R.; Winpenny, R. E. P.; Santini, P.

    2016-01-01

    We investigate the magnetic properties and the phonon-induced relaxation dynamics of the first regular Cr9 antiferromagnetic (AF) ring, which represents a prototype frustrated AF ring. Geometrical frustration in Cr9 yields an energy spectrum with twofold degenerate low-lying levels and a low-spin ground state. The electronic relaxation dynamics is probed by 1H -NMR through the temperature dependence of the spin-lattice relaxation rate 1 /T1 . We develop a microscopic model that reproduces 1 /T1(T ) curves, taking also into account the wipeout effect. By interpreting these measurements we determine the spin-phonon coupling strength and we investigate the decay of the cluster magnetization due to the spin-phonon interaction. We find that at very low temperatures, the relaxation is characterized by a single dominating Arrhenius-type relaxation process, whereas several relevant processes emerge at higher temperatures. In addition, we calculate the temperature and magnetic field dependence of level lifetimes.

  9. Transverse modes in microchip lasers

    SciTech Connect

    Sanchez, F.; Chardon, A.

    1996-12-01

    Two analytical sets of transverse eigenmodes are proposed for microchip lasers in one-dimensional geometry. Each set is associated with a particular pump profile. The eigenfunctions are expressed as Bessel or modified Bessel functions. {copyright} {ital 1996 Optical Society of America.}

  10. Transverse effects in UV FELs

    SciTech Connect

    Small, D.W.; Wong, R.K.; Colson, W.B.

    1995-12-31

    In an ultraviolet Free Electron Laser (UV FEL), the electron beam size can be approximately the same as the optical mode size. The performance of a UV FEL is studied including the effect of emittance, betatron focusing, and external focusing of the electron beam on the transverse optical mode. The results are applied to the Industrial Laser Consortium`s UV FEL.

  11. Transverse Magnetic Field Propellant Isolator

    NASA Technical Reports Server (NTRS)

    Foster, John E.

    2000-01-01

    An alternative high voltage isolator for electric propulsion and ground-based ion source applications has been designed and tested. This design employs a transverse magnetic field that increases the breakdown voltage. The design can greatly enhance the operating range of laboratory isolators used for high voltage applications.

  12. Visual stimulation, 1H MR spectroscopy and fMRI of the human visual pathways.

    PubMed

    Boucard, Christine C; Mostert, Jop P; Cornelissen, Frans W; De Keyser, Jacques; Oudkerk, Matthijs; Sijens, Paul E

    2005-01-01

    The purpose was to assess changes in lactate content and other brain metabolites under visual stimulation in optical chiasm, optic radiations and occipital cortex using multiple voxel MR spectroscopy (MRS). 1H chemical shift imaging (CSI) examinations of transverse planes centered to include the above structures were performed in four subjects at an echo time of 135 ms. Functional MRI (fMRI) was used to confirm the presence of activity in the visual cortex during the visual stimulation. Spectral maps of optical chiasm were of poor quality due to field disturbances caused by nearby large blood vessels and/or eye movements. The optic radiations and the occipital lobe did not show any significant MR spectral change upon visual stimulation, i.e., the peak areas of inositol, choline, creatine, glutamate and N-acetylaspartate were not affected. Reproducible lactate signals were not observed. fMRI confirmed the presence of strong activations in stimulated visual cortex. Prolonged visual stimulation did not cause significant changes in MR spectra. Any signal observed near the 1.33 ppm resonance frequency of the lactate methyl-group was artifactual, originating from lipid signals from outside the volume of interest (VOI). Previous claims about changes in lactate levels in the visual cortex upon visual stimulation may have been based on such erroneous observations. PMID:15480690

  13. Crystal structure of 1H,1'H-[2,2'-biimid-azol]-3-ium hydrogen tartrate hemi-hydrate.

    PubMed

    Gao, Xiao-Li; Bian, Li-Fang; Guo, Shao-Wei

    2014-11-01

    In the crystal of the title hydrated salt, C6H7N4 (+)·C4H5O6 (-)·0.5H2O, the bi-imidazole monocation, 1H,1'H-[2,2'-biimidazol]-3-ium, is hydrogen bonded, via N-H⋯O, O-H⋯O and O-H⋯N hydrogen bonds, to the hydrogen tartrate anion and the water mol-ecule, which is located on a twofold rotation axis, forming sheets parallel to (001). The sheets are linked via C-H⋯O hydrogen bonds, forming a three-dimensional structure. There are also C=O⋯π inter-actions present [O⋯π distances are 3.00 (9) and 3.21 (7) Å], involving the carbonyl O atoms and the imidazolium ring, which may help to consolidate the structure. In the cation, the dihedral angle between the rings is 11.6 (2)°.

  14. Complexation of oxygen ligands with dimeric rhodium(II) tetrakistrifluoroacetate in chloroform: 1H, 13C NMR and DFT studies

    NASA Astrophysics Data System (ADS)

    Głaszczka, Rafał; Jaźwiński, Jarosław

    2013-03-01

    The complexation of dimeric rhodium(II) tetrakistrifluoroacetylate with 25 ligands containing oxygen atoms: alcohols, ethers, ketones, aldehydes, carboxylic acids and esters in chloroform solution have been investigated by 1H and 13C NMR spectroscopy and Density Functional Theory (DFT) methods. Investigated ligands form 1:1 adducts in our experimental conditions, with stability constants in the order of several hundred mol-1. The exchange of ligands in solution is fast on the NMR spectroscopic timescale. The decrease of longitudinal relaxation times T1 in ligands in the presence of rhodium salt has been tested as the means of determination of the complexation site in ligands. The influence of complexation on chemical shifts in ligands was evaluated by a parameter complexation shift Δδ (Δδ = δadd - δlig). These parameters were positive (>0 ppm) and did not exceed 1 ppm for 1H NMR; and varied from ca. -5 to +15 ppm in the case of 13C NMR. The calculation by DFT methods using the B3LYP functional (structure optimization, electronic energy) and B3PW91 functional (shielding), and combinations of the (6-31G(2d), 6-311G++(2d,p), and LANL2DZ basis sets, followed by scaling procedures reproduced satisfactorily 1H and 13C chemical shifts and, with some limitations, allowed to estimate Δδ parameters.

  15. High K+-Induced Relaxation by Nitric Oxide in Human Gastric Fundus

    PubMed Central

    Kim, Dae Hoon; Choi, Woong; Sung, Rohyun; Kim, Hun Sik; Kim, Heon; Yoo, Ra Young; Park, Seon-Mee; Yun, Sei Jin; Song, Young-Jin; Xu, Wen-Xie; Lee, Sang Jin

    2012-01-01

    This study was designed to elucidate high K+-induced relaxation in the human gastric fundus. Circular smooth muscle from the human gastric fundus greater curvature showed stretch-dependent high K+ (50 mM)-induced contractions. However, longitudinal smooth muscle produced stretch-dependent high K+-induced relaxation. We investigated several relaxation mechanisms to understand the reason for the discrepancy. Protein kinase inhibitors such as KT 5823 (1 µM) and KT 5720 (1 µM) which block protein kinases (PKG and PKA) had no effect on high K+-induced relaxation. K+ channel blockers except 4-aminopyridine (4-AP), a voltage-dependent K+ channel (KV) blocker, did not affect high K+-induced relaxation. However, N(G)-nitro-L-arginine and 1H-(1,2,4)oxadiazolo (4,3-A)quinoxalin-1-one, an inhibitors of soluble guanylate cyclase (sGC) and 4-AP inhibited relaxation and reversed relaxation to contraction. High K+-induced relaxation of the human gastric fundus was observed only in the longitudinal muscles from the greater curvature. These data suggest that the longitudinal muscle of the human gastric fundus greater curvature produced high K+-induced relaxation that was activated by the nitric oxide/sGC pathway through a KV channel-dependent mechanism. PMID:23118553

  16. In vivo 1H chemical shift imaging of silicone implants.

    PubMed

    Pfleiderer, B; Ackerman, J L; Garrido, L

    1993-05-01

    In order to study the aging process (i.e., silicone migration, fat infiltration) of silicone (polydimethylsiloxane, PDMS) based biomaterials in living subjects by NMR imaging, a hybrid 1H selective excitation and saturation chemical shift imaging technique (IR/CHESS-CSSE) has been developed. This sequence allows selective mapping of the distribution of silicone protons in vivo, while suppressing the contributions of fat and water. Our results indicate that a combined inversion recovery and CHESS pulse, followed by a spoiler gradient, must be applied to suppress all contributions of fat protons to the NMR signal. The sensitivity of our experiments allows the detection of a chemically unchanged silicone concentration of 5% in a voxel of 0.9 mm3 at a signal/noise ratio of 2.

  17. One dimensional 1H, 2H and 3H

    NASA Astrophysics Data System (ADS)

    Vidal, A. J.; Astrakharchik, G. E.; Vranješ Markić, L.; Boronat, J.

    2016-05-01

    The ground-state properties of one-dimensional electron-spin-polarized hydrogen 1H, deuterium 2H, and tritium 3H are obtained by means of quantum Monte Carlo methods. The equations of state of the three isotopes are calculated for a wide range of linear densities. The pair correlation function and the static structure factor are obtained and interpreted within the framework of the Luttinger liquid theory. We report the density dependence of the Luttinger parameter and use it to identify different physical regimes: Bogoliubov Bose gas, super-Tonks-Girardeau gas, and quasi-crystal regimes for bosons; repulsive, attractive Fermi gas, and quasi-crystal regimes for fermions. We find that the tritium isotope is the one with the richest behavior. Our results show unambiguously the relevant role of the isotope mass in the properties of this quantum system.

  18. Study of aqueous humour by 1H NMR spectroscopy

    NASA Astrophysics Data System (ADS)

    Tkadlecová, Marcela; Havlíček, Jaroslav; Volka, Karel; Souček, Petr; Karel, Ivan

    1999-05-01

    The aim of this work was to study the composition of the samples of human aqueous humour including the protein content. Using 1H NMR spectroscopy many compounds (proteins, glucose, lactate, citrate and other metabolites) can be identified and their concentrations evaluated using the internal standard. While the concentrations of non-proteins in aqueous humour were relatively stable, the amount of proteins differed much more. In most of the spectra, the signals of proteins were hardly distinguishable from the baseline. For some samples a significantly higher protein content (more than 1 mg/ml) was found. The total protein concentration expressed in albumin equivalents can be determined by comparing the spectra measured by S2PUL (standard measurement) and CPMG (protein suppression) pulse sequentions. For comparison, the spectra of rabbit and bovine aqueous humour are also given.

  19. Purity Assessment of Aryltetralin Lactone Lignans by Quantitative 1H Nuclear Magnetic Resonance.

    PubMed

    Sun, Yan-Jun; Zhang, Yan-Li; Wang, Yu; Wang, Jun-Min; Zhao, Xuan; Gong, Jian-Hong; Gao, Wei; Guan, Yan-Bin

    2015-01-01

    In the present work, a quantitative 1H Nuclear Magnetic Resonance (qHNMR) was established for purity assessment of six aryltetralin lactone lignans. The validation of the method was carried out, including specificity, selectivity, linearity, accuracy, precision, and robustness. Several experimental parameters were optimized, including relaxation delay (D1), scan numbers (NS), and pulse angle. 1,4-Dinitrobenzene was used as internal standard (IS), and deuterated dimethyl sulfoxide (DMSO-d6) as the NMR solvent. The purities were calculated by the area ratios of H-2,6 from target analytes vs. aromatic protons from IS. Six aryltetralin lactone lignans (deoxypodophyllotoxin, podophyllotoxin, 4-demethylpodophyllotoxin, podophyllotoxin-7'-O-β-d-glucopyranoside, 4-demethylpodophyllotoxin-7'-O-β-d-glucopyranoside, and 6''-acetyl-podophyllotoxin-7'-O-β -d-glucopyranoside) were analyzed. The analytic results of qHNMR were further validated by high performance liquid chromatography (HPLC). Therefore, the qHNMR method was a rapid, accurate, reliable tool for monitoring the purity of aryltetralin lactone lignans. PMID:26016553

  20. 1H-NMR measurements of proton mobility in nano-crystalline YSZ.

    PubMed

    Hinterberg, Judith; Adams, Alina; Blümich, Bernhard; Heitjans, Paul; Kim, Sangtae; Munir, Zuhair A; Martin, Manfred

    2013-12-01

    We report nuclear magnetic resonance (NMR) results on water saturated, dense, nano-crystalline YSZ samples (9.5 mol% yttria doped zirconia) which exhibit proton conductivity at temperatures as low as room temperature. (1)H-NMR spectra recorded under static and magic angle spinning conditions show two distinct signals. Their temperature-dependent behavior and their linewidths suggest that one can be attributed to (free) water adsorbed on the surface of the sample and the other one to mobile protons within the sample. This interpretation is supported by comparison with measurements on a single-crystalline sample. For the nano-crystalline samples motional narrowing is observed for the signal originating from protons in the sample interior. For these protons, the analysis of temperature and field dependent spin-lattice relaxation time T1 points towards diffusion in a confined two-dimensional geometry. We attribute this quasi two-dimensional motion to protons that are mobile along internal interfaces or nanopores of nano-crystalline YSZ.

  1. Curie-type paramagnetic NMR relaxation in the aqueous solution of Ni(II).

    PubMed

    Mareš, Jiří; Hanni, Matti; Lantto, Perttu; Lounila, Juhani; Vaara, Juha

    2014-04-21

    Ni(2+)(aq) has been used for many decades as a model system for paramagnetic nuclear magnetic resonance (pNMR) relaxation studies. More recently, its magnetic properties and also nuclear magnetic relaxation rates have been studied computationally. We have calculated electron paramagnetic resonance and NMR parameters using quantum-mechanical (QM) computation of molecular dynamics snapshots, obtained using a polarizable empirical force field. Statistical averages of hyperfine coupling, g- and zero-field splitting tensors, as well as the pNMR shielding terms, are compared to the available experimental and computational data. In accordance with our previous work, the isotropic hyperfine coupling as well as nuclear shielding values agree well with experimental measurements for the (17)O nuclei of water molecules in the first solvation shell of the nickel ion, whereas larger deviations are found for (1)H centers. We report, for the first time, the Curie-type contribution to the pNMR relaxation rate using QM calculations together with Redfield relaxation theory. The Curie relaxation mechanism is analogous to chemical shift anisotropy relaxation, well-known in diamagnetic NMR. Due to the predominance of other types of paramagnetic relaxation mechanisms for this system, it is possible to extract the Curie term only computationally. The Curie mechanism alone would result in around 16 and 20 s(-1) of relaxation rates (R1 and R2 respectively) for the (1)H nuclei of water molecules bonded to the Ni(2+) center, in a magnetic field of 11.7 T. The corresponding (17)O relaxation rates are around 33 and 38 s(-1). We also report the Curie contribution to the relaxation rate for molecules beyond the first solvation shell in a 1 M solution of Ni(2+) in water.

  2. Determination of relative orientation between (1)H CSA tensors from a 3D solid-state NMR experiment mediated through (1)H/(1)H RFDR mixing under ultrafast MAS.

    PubMed

    Pandey, Manoj Kumar; Nishiyama, Yusuke

    2015-09-01

    To obtain piercing insights into inter and intramolecular H-bonding, and π-electron interactions measurement of (1)H chemical shift anisotropy (CSA) tensors is gradually becoming an obvious choice. While the magnitude of CSA tensors provides unique information about the local electronic environment surrounding the nucleus, the relative orientation between these tensors can offer further insights into the spatial arrangement of interacting nuclei in their respective three-dimensional (3D) space. In this regard, we present a 3D anisotropic/anisotropic/isotropic proton chemical shift (CSA/CSA/CS) correlation experiment mediated through (1)H/(1)H radio frequency-driven recoupling (RFDR) which enhances spin diffusion through recoupled (1)H-(1)H dipolar couplings under ultrafast magic angle spinning (MAS) frequency (70kHz). Relative orientation between two interacting 1H CSA tensors is obtained by fitting two-interacting (1)H CSA tensors by fitting two-dimensional (2D) (1)H/(1)H CSA/CSA spectral slices through extensive numerical simulations. To recouple (1)H CSAs in the indirect frequency dimensions of a 3D experiment we have employed γ-encoded radio frequency (RF) pulse sequence based on R-symmetry (R188(7)) with a series of phase-alternated 2700(°)-90180(°) composite-180° pulses on citric acid sample. Due to robustness of applied (1)H CSA recoupling sequence towards the presence of RF field inhomogeneity, we have successfully achieved an excellent (1)H/(1)H CSA/CSA cross-correlation efficiency between H-bonded sites of citric acid. PMID:26065628

  3. Rotating frame relaxation during adiabatic pulses versus conventional spin-lock: simulations and experimental results at 4T

    PubMed Central

    Mangia, Silvia; Liimatainen, Timo; Garwood, Michael; Michaeli, Shalom

    2009-01-01

    Spin relaxation taking place during radiofrequency (RF) irradiation can be assessed by measuring the longitudinal and transverse rotating frame relaxation rate constants (R1ρ and R2ρ). These relaxation parameters can be altered by utilizing different settings of the RF irradiation, thus providing a useful tool to generate contrast in MRI. In this work we investigate the dependencies of R1ρ and R2ρ due to dipolar interactions and anisochronous exchange (i.e., exchange between spins with different chemical shift δω≠0) on the properties of conventional spin-lock and adiabatic pulses, with particular emphasis on the latter ones which were not fully described previously. The results of simulations based on relaxation theory provide a foundation for formulating practical considerations for in vivo applications of rotating frame relaxation methods. Rotating frame relaxation measurements obtained from phantoms and from the human brain at 4T are presented to confirm the theoretical predictions. PMID:19559559

  4. Effects of T2-relaxation in MAS NMR spectra of the satellite transitions for quadrupolar nuclei: a 27Al MAS and single-crystal NMR study of alum KAl(SO 4) 2 · 12H 2O

    NASA Astrophysics Data System (ADS)

    Andersen, Morten Daugaard; Jakobsen, Hans J.; Skibsted, Jørgen

    2005-04-01

    Asymmetries in the manifold of spinning sidebands (ssbs) from the satellite transitions have been observed in variable-temperature 27Al MAS NMR spectra of alum (KAl(SO 4) 2 · 12H 2O), recorded in the temperature range from -76 to 92 °C. The asymmetries decrease with increasing temperature and reflect the fact that the ssbs exhibit systematically different linewidths for different spectral regions of the manifold. From spin-echo 27Al NMR experiments on a single-crystal of alum, it is demonstrated that these variations in linewidth originate from differences in transverse ( T2) relaxation times for the two inner ( m = 1/2 ↔ m = 3/2 and m = -1/2 ↔ m = -3/2) and correspondingly for the two outer ( m = 3/2 ↔ m = 5/2 and m = -3/2 ↔ m = -5/2) satellite transitions. T2 relaxation times in the range 0.5-3.5 ms are observed for the individual satellite transitions at -50 °C and 7.05 T, whereas the corresponding T1 relaxation times, determined from similar saturation-recovery 27Al NMR experiments, are almost constant ( T1 = 0.07-0.10 s) for the individual satellite transitions. The variation in T2 values for the individual 27Al satellite transitions for alum is justified by a simple theoretical approach which considers the cross-correlation of the local fluctuating fields from the quadrupolar coupling and the heteronuclear ( 27Al- 1H) dipolar interaction on the T2 relaxation times for the individual transitions. This approach and the observed differences in T2 values indicate that a single random motional process modulates both the quadrupolar and heteronuclear dipolar interactions for 27Al in alum at low temperatures.

  5. Nonequilibrium quantum relaxation across a localization-delocalization transition

    NASA Astrophysics Data System (ADS)

    Roósz, Gergő; Divakaran, Uma; Rieger, Heiko; Iglói, Ferenc

    2014-11-01

    We consider the one-dimensional X X model in a quasiperiodic transverse field described by the Harper potential, which is equivalent to a tight-binding model of spinless fermions with a quasiperiodic chemical potential. For weak transverse field (chemical potential), h hc . We study the nonequilibrium relaxation of the system by applying two protocols: a sudden change of h (quench dynamics) and a slow change of h in time (adiabatic dynamics). For a quench into the delocalized (localized) phase, the entanglement entropy grows linearly (saturates) and the order parameter decreases exponentially (has a finite limiting value). For a critical quench the entropy increases algebraically with time, whereas the order parameter decreases with a stretched exponential. The density of defects after an adiabatic field change through the critical point is shown to scale with a power of the rate of field change and a scaling relation for the exponent is derived.

  6. Magnetic phases and relaxation effects in fullerite C60

    NASA Astrophysics Data System (ADS)

    Chigvinadze, J. G.; Buntar, V.; Ashimov, S. M.; Dolbin, A. V.

    2016-02-01

    A highly sensitive torsional vibration technique is used to study the magnetic properties of fullerite C60 (99.98%) at temperatures of 77-300 K in dynamic and static experiments. Vibrational energy absorption peaks associated with phase transitions and realignment of the magnetic structure of the fullerite are detected at T = 152, 195, 230, and 260 K. Relaxation magnetic processes in fullerite C60 at room temperature are studied. "Spontaneous" rotation of a motionless sample of fullerite freely suspended on an elastic filament is observed when external longitudinal or transverse magnetic fields are switched on. The direction of the "spontaneous" rotation changes with time. It is proposed that these phenomena are related to relaxation processes in the rotational subsystem of C60 molecular rotators, as well as to magnetic flux trapped in the fullerite and weakly damped eddy currents induced in the sample by the applied field.

  7. [Indications for relaxation in geriatrics].

    PubMed

    Richard, J; Picot, A; de Bus, P; Andreoli, A; Dalakaki, X

    1975-11-01

    On a three years base experience in the geriatiic department of Geneva's University Psychiatric Clinic the paper studies the problem of selecting aged patients to be treated by relaxation according to the method of J. De Ajuriaguerra et M. Cahen. Observations are presented in an attempt to define three main points: a) the role played by relaxation when there is an objective [corrected] impairment of the body's integrity; b) relaxation effect on aged persons neurotic states evolution; c) the reality of considering dementia as a counter-indication of relaxation therapy. These remarks complete those presented previously about the training of therapists in relaxation, the type of control to be organized for them and their patients, the technical management of the cure, the place of relaxation in the post graduate psychiatric training, the effects of the therapy on the patients human environnement behavior in and out of the hospital, the way body is perceived through relaxation by the aged patients and it's consequences on the adjustment of an aging person.

  8. Observation of laser transverse modes analogous to a SU(2) wave packet of a quantum harmonic oscillator

    SciTech Connect

    Chen, Y.F.; Lan, Y.P.

    2002-11-01

    We report the generation of a new type of laser transverse mode that is analogous to a SU(2) elliptical wave packet of a quantum harmonic oscillator. Experimental results show that using a doughnut pump profile to excite an isotropic microchip laser in a spherical cavity can generate the elliptical transverse modes. The formation of elliptical transverse modes is found to be a spontaneous locking process of Hermite-Gaussian modes within the same family. The chaotic relaxation oscillation caused by the interaction of two nearly degenerate elliptical modes is also observed.

  9. Heteronuclear Cross-Relaxation Effects in the NMR Spectroscopy of Hyperpolarized Targets

    PubMed Central

    Donovan, Kevin J.; Lupulescu, Adonis; Frydman, Lucio

    2016-01-01

    Dissolution DNP enables high-sensitivity solution phase NMR experiments on long-lived nuclear spin species such as 15N and 13C. This report explores certain features arising in solution-state 1H NMR, upon polarizing low-γ nuclear species. Following solid state hyperpolarization of both 13C and 1H, solution-phase 1H NMR experiments on dissolved samples revealed transient effects whereby peaks arising from protons bonded to the naturally-occurring 13C nuclei, appeared larger than the typically dominant 12C-bonded 1H resonances. This enhancement of the satellite-peaks was examined in detail, with respect to a variety of mechanisms that could potentially originate it. Both two- and three-spin phenomena active in the solid state could lead to this kind of effect; still, experimental observations revealed that the enhancement originates from 13C→1H polarization transfer processes active in the liquid state. Kinetic equations based on modified heteronuclear cross-relaxation models were examined, and found to describe well the distinct patterns of growth and decay shown by the 13C-bound 1H NMR satellite resonances. The dynamics of these novel cross-relaxation phenomena were determined, and their potential usefulness as tools for investigating hyperpolarized ensembles and for obtaining enhanced-sensitivity 1H NMR traces, is explored. PMID:24403222

  10. Change of translational-rotational coupling in liquids revealed by field-cycling {sup 1}H NMR

    SciTech Connect

    Meier, R.; Schneider, E.; Rössler, E. A.

    2015-01-21

    Applying the field-cycling nuclear magnetic resonance technique, the frequency dependence of the {sup 1}H spin-lattice relaxation rate, R{sub 1}(ω)=T{sub 1}{sup −1}(ω), is measured for propylene glycol (PG) which is increasingly diluted with deuterated chloroform. A frequency range of 10 kHz–20 MHz and a broad temperature interval from 220 to about 100 K are covered. The results are compared to those of experiments, where glycerol and o-terphenyl are diluted with their deuterated counter-part. Reflecting intra- as well as intermolecular relaxation, the dispersion curves R{sub 1}(ω,x) (x denotes mole fraction PG) allow to extract the rotational time constant τ{sub rot}(T, x) and the self-diffusion coefficient D(T, x) in a single experiment. The Stokes-Einstein-Debye (SED) relation is tested in terms of the quantity D(T, x) τ{sub rot}(T, x) which provides a measure of an effective hydrodynamic radius or equivalently of the spectral separation of the translational and the rotational relaxation contribution. In contrast to o-terphenyl, glycerol and PG show a spectral separation much larger than suggested by the SED relation. In the case of PG/chloroform mixtures, not only an acceleration of the PG dynamics is observed with increasing dilution but also the spectral separation of rotational and translational relaxation contributions continuously decreases. Finally, following a behavior similar to that of o-terphenyl already at about x = 0.6; i.e., while D(T, x) τ{sub rot}(T, x) in the mixture is essentially temperature independent, it strongly increases with x signaling thus a change of translational-rotational coupling. This directly reflects the dissolution of the hydrogen-bond network and thus a change of solution structure.

  11. Progressive muscle relaxation, breathing exercises, and ABC relaxation theory.

    PubMed

    Matsumoto, M; Smith, J C

    2001-12-01

    This study compared the psychological effects of Progressive Muscle Relaxation (PMR) and breathing exercises. Forty-two students were divided randomly into two groups and taught PMR or breathing exercises. Both groups practiced for five weeks and were given the Smith Relaxation States Inventory before and after each session. As hypothesized, PMR practitioners displayed greater increments in relaxation states (R-States) Physical Relaxation and Disengagement, while breathing practitioners displayed higher levels of R-State Strength and Awareness. Slight differences emerged at Weeks 1 and 2; major differences emerged at Weeks 4 and 5. A delayed and potentially reinforcing aftereffect emerged for PMR only after five weeks of training--increased levels of Mental Quiet and Joy. Clinical and theoretical implications are discussed.

  12. Suppression of Spin-Exchange Relaxation Using Pulsed Parametric Resonance

    NASA Astrophysics Data System (ADS)

    Korver, A.; Wyllie, R.; Lancor, B.; Walker, T. G.

    2013-07-01

    We demonstrate that spin-exchange dephasing of Larmor precession at near-Earth-scale fields is effectively eliminated by dressing the alkali-metal atom spins in a sequence of ac-coupled 2π pulses, repeated at the Larmor precession frequency. The contribution of spin-exchange collisions to the spectroscopic linewidth is reduced by a factor of the duty cycle of the pulses. We experimentally demonstrate resonant transverse pumping in magnetic fields as high as 0.1 G, present experimental measurements of the suppressed spin-exchange relaxation, and show enhanced magnetometer response relative to a light-narrowed scalar magnetometer.

  13. Studies of MRI relaxivities of gadolinium-labeled dendrons

    NASA Astrophysics Data System (ADS)

    Pan, Hongmu; Daniel, Marie-Christine

    2011-05-01

    In cancer detection, imaging techniques have a great importance in early diagnosis. The more sensitive the imaging technique and the earlier the tumor can be detected. Contrast agents have the capability to increase the sensitivity in imaging techniques such as magnetic resonance imaging (MRI). Until now, gadolinium-based contrast agents are mainly used for MRI, and show good enhancement. But improvement is needed for detection of smaller tumors at the earliest stage possible. The dendrons complexed with Gd(DOTA) were synthesized and evaluated as a new MRI contrast agent. The longitudinal and transverse relaxation effects were tested and compared with commercial drug Magnevist, Gd(DTPA).

  14. Can Black Hole Relax Unitarily?

    NASA Astrophysics Data System (ADS)

    Solodukhin, S. N.

    2005-03-01

    We review the way the BTZ black hole relaxes back to thermal equilibrium after a small perturbation and how it is seen in the boundary (finite volume) CFT. The unitarity requires the relaxation to be quasi-periodic. It is preserved in the CFT but is not obvious in the case of the semiclassical black hole the relaxation of which is driven by complex quasi-normal modes. We discuss two ways of modifying the semiclassical black hole geometry to maintain unitarity: the (fractal) brick wall and the worm-hole modification. In the latter case the entropy comes out correctly as well.

  15. Backbone dynamics of barstar: a (15)N NMR relaxation study.

    PubMed

    Sahu, S C; Bhuyan, A K; Majumdar, A; Udgaonkar, J B

    2000-12-01

    Backbone dynamics of uniformly (15)N-labeled barstar have been studied at 32 degrees C, pH 6.7, by using (15)N relaxation data obtained from proton-detected 2D (1)H-(15)N NMR spectroscopy. (15)N spin-lattice relaxation rate constants (R(1)), spin-spin relaxation rate constants (R(2)), and steady-state heteronuclear (1)H-(15)N NOEs have been determined for 69 of the 86 (excluding two prolines and the N-terminal residue) backbone amide (15)N at a magnetic field strength of 14.1 Tesla. The primary relaxation data have been analyzed by using the model-free formalism of molecular dynamics, using both isotropic and axially symmetric diffusion of the molecule, to determine the overall rotational correlation time (tau(m)), the generalized order parameter (S(2)), the effective correlation time for internal motions (tau(e)), and NH exchange broadening contributions (R(ex)) for each residue. As per the axially symmetric diffusion, the ratio of diffusion rates about the unique and perpendicular axes (D( parallel)/D( perpendicular)) is 0.82 +/- 0.03. The two results have only marginal differences. The relaxation data have also been used to map reduced spectral densities for the NH vectors of these residues at three frequencies: 0, omega(H), and omega(N), where omega(H),(N) are proton and nitrogen Larmor frequencies. The value of tau(m) obtained from model-free analysis of the relaxation data is 5.2 ns. The reduced spectral density analysis, however, yields a value of 5.7 ns. The tau(m) determined here is different from that calculated previously from time-resolved fluorescence data (4.1 ns). The order parameter ranges from 0.68 to 0.98, with an average value of 0.85 +/- 0.02. A comparison of the order parameters with the X-ray B-factors for the backbone nitrogens of wild-type barstar does not show any considerable correlation. Model-free analysis of the relaxation data for seven residues required the inclusion of an exchange broadening term, the magnitude of which ranges from 2

  16. Transverse angular momentum of photons

    SciTech Connect

    Aiello, Andrea

    2010-05-15

    We develop the quantum theory of transverse angular momentum of light beams. The theory applies to paraxial and quasiparaxial photon beams in vacuum and reproduces the known results for classical beams when applied to coherent states of the field. Both the Poynting vector, alias the linear momentum, and the angular-momentum quantum operators of a light beam are calculated including contributions from first-order transverse derivatives. This permits a correct description of the energy flow in the beam and the natural emergence of both the spin and the angular momentum of the photons. We show that for collimated beams of light, orbital angular-momentum operators do not satisfy the standard commutation rules. Finally, we discuss the application of our theory to some concrete cases.

  17. Simulation of DNA Supercoil Relaxation.

    PubMed

    Ivenso, Ikenna D; Lillian, Todd D

    2016-05-24

    Several recent single-molecule experiments observe the response of supercoiled DNA to nicking endonucleases and topoisomerases. Typically in these experiments, indirect measurements of supercoil relaxation are obtained by observing the motion of a large micron-sized bead. The bead, which also serves to manipulate DNA, experiences significant drag and thereby obscures supercoil dynamics. Here we employ our discrete wormlike chain model to bypass experimental limitations and simulate the dynamic response of supercoiled DNA to a single strand nick. From our simulations, we make three major observations. First, extension is a poor dynamic measure of supercoil relaxation; in fact, the linking number relaxes so fast that it cannot have much impact on extension. Second, the rate of linking number relaxation depends upon its initial partitioning into twist and writhe as determined by tension. Third, the extensional response strongly depends upon the initial position of plectonemes.

  18. 3-hydroxy-2(1H)-pyridinone chelating agents

    DOEpatents

    Raymond, Kenneth N.; Xu, Jide

    1997-01-01

    Disclosed is a series of improved metal chelating agents, which are highly effective upon both injection and oral administration; several of the most effective are of low toxicity. These chelating agents incorporate within their structure 1-hydroxy-2-pyridinone (1,2-HOPO) and 3-hydroxy-2-pyridinone (3,2-HOPO) moieties with a substituted carbamoyl group ortho to the hydroxy or oxo groups of the hydroxypyridinone ring. The electron-withdrawing carbamoyl group increases the acidity of the hydroxypyridinones. In the metal complexes of said chelating agents, the amide protons form very strong hydrogen bonds with its adjacent HOPO oxygen donor, making these complexes very stable at physiological conditions. The terminal N-substituents provides a certain degree of lipophilicity to said 3,2-HOPO, increasing oral activity. Also disclosed is a method of making the chelating agents and a method of producing a known compound, 3-hydroxy-1-alkyl-2(1H)pyridinone, used as a precursor to the chelating agent, safely and in large quantities.

  19. 3-hydroxy-2(1H)-pyridinone chelating agents

    DOEpatents

    Raymond, K.N.; Xu, J.

    1997-04-29

    Disclosed is a series of improved metal chelating agents, which are highly effective upon both injection and oral administration; several of the most effective are of low toxicity. These chelating agents incorporate within their structure 1-hydroxy-2-pyridinone (1,2-HOPO) and 3-hydroxy-2-pyridinone (3,2-HOPO) moieties with a substituted carbamoyl group ortho to the hydroxy or oxo groups of the hydroxypyridinone ring. The electron-withdrawing carbamoyl group increases the acidity of the hydroxypyridinones. In the metal complexes of the chelating agents, the amide protons form very strong hydrogen bonds with its adjacent HOPO oxygen donor, making these complexes very stable at physiological conditions. The terminal N-substituents provides a certain degree of lipophilicity to the 3,2-HOPO, increasing oral activity. Also disclosed is a method of making the chelating agents and a method of producing a known compound, 3-hydroxy-1-alkyl-2(1H)pyridinone, used as a precursor to the chelating agent, safely and in large quantities. 2 figs.

  20. 1H homonuclear editing of rat brain using semiselective pulses

    SciTech Connect

    Hetherington, H.P.; Avison, M.J.; Shulman, R.G.

    1985-05-01

    The authors have used a semiselective Hahn spin-echo sequence of the form (1331)-tau-(2662)-tau-AQ, delivered by a surface coil to obtain high-resolution 1H NMR spectra from the brains of intact dead rats. This sequence gave suppression of the tissue water resonance by a factor of 80,000 when tau = 68 ms. Delivery of a frequency-selective Dante pulse train to the alpha-CH resonance of lactate at 4.11 ppm, simultaneously with the 2662 refocusing pulse, altered the j-modulation in the spin-coupled beta-CH3 protons. Subtraction of this spectrum from one in which the Dante was ineffective gave an edited spectrum containing only the beta-CH3 resonance of lactate at 1.31 ppm. When the position of the Dante was shifted to 3.78 ppm to selectively invert the alpha-CH protons of alanine, an edited spectrum of alanine was obtained.

  1. Transverse spin effects at COMPASS

    SciTech Connect

    Pesaro, G.

    2009-03-23

    The COMPASS experiment at the CERN SPS has a broad physics program focused on the nucleon spin structure and on hadron spectroscopy, using both muon and hadron beams. One of the main objectives for the spin program with the muon beam is the measurement of transverse spin effects in semi inclusive deep inelastic scattering. A longitudinally polarized 160 GeV/c muon beam is impinging on a transversely polarized target: from 2002 to 2004 a {sup 6}LiD(deuteron) target has been used, while during 2007 data taking a NH{sub 3}(proton) target was put in place. All measured transverse asymmetries on deuteron have been found to be small, and compatible with zero, within the few percent statistical errors. These results, which are currently used as input for global fits, can be interpreted as cancellation between u and d quark contribution in the deuteron. The first results for the Collins and Sivers asymmetries for charged hadrons from the 2007 proton COMPASS data are also presented and discussed.

  2. QCD Evolution of Helicity and Transversity TMDs

    SciTech Connect

    Prokudin, Alexei

    2014-01-01

    We examine the QCD evolution of the helicity and transversity parton distribution functions when including also their dependence on transverse momentum. Using an appropriate definition of these polarized transverse momentum distributions (TMDs), we describe their dependence on the factorization scale and rapidity cutoff, which is essential for phenomenological applications.

  3. Deriving NMR surface relaxivities, pore size distributions and water retention curves by NMR relaxation experiments on partially de-saturated rocks

    NASA Astrophysics Data System (ADS)

    Mohnke, O.; Nordlund, C. L.; Klitzsch, N.

    2013-12-01

    Nuclear magnetic resonance (NMR) is a method used over a wide field of geophysical applications to non-destructively determine transport and storage properties of rocks and soils. In NMR relaxometry signal amplitudes correspond directly to the rock's fluid (water, oil) content. On the other hand the NMR relaxation behavior, i.e. the longitudinal (T1) and transverse (T2) NMR relaxation times, can be used to derive pore sizes and permeability as it is linearly linked to the pore's surface-to-volume-ratio and physiochemical properties of the rock-fluid interface by the surface relaxivity ρ_s This parameter, however, is dependent on the type and mineral constituents of the investigated rock sample and thus has to be determined and calibrated prior to estimating pore sizes from NMR relaxometry measurements. Frequently used methods to derive surface relaxivity to calibrate NMR pore sizes comprise mercury injection, pulsed field gradients (PFG-NMR) or grain size analysis. This study introduces an alternative approach to jointly estimate NMR surface relaxivity and pore radii distributions using NMR relaxation data obtained from partially de-saturated rocks. In this, inverse modeling is carried on a linked Young Laplace equation for capillary bundles and the Brownstein and Tarr equations. Subsequently, this approach is used to predict water retention curves of the investigated rocks. The method was tested and validated on simulated and laboratory transverse NMR data. Calculated inverse models are generally in a good agreement with results obtained from mercury injection and drainage measurements. Left: Measured and predicted water retention (pF) curves. Center: NMR relaxometry data, fit and error. Right: Mercury injection data (HgPor, dashed line) and jointly derived pore radii distributions and surface relaxivity by joint inverse modelling

  4. Non-Conservation of Transverse Magnetization in Spin Diffusion in Trapped Boltzmann Gases

    SciTech Connect

    Ragan, R. J.; Mullin, W. J.

    2006-09-07

    Experiments in a mixture of two hyperfine states of trapped Bose gases show behavior analogous to a spin-1/2 system, including transverse spin waves and other familiar Leggett-Rice-type effects. We have derived the kinetic equations applicable to these systems, including the spin dependence of interparticle interactions in the collision integral. We find that the hydrodynamic diffusive modes cease to exist because interactions with different scattering lengths for up-up, up-down, and down-down spins lead to a spin-spin relaxation, that causes non-conservation of transverse magnetization. We give results for the quadrupole modes, the modes studied in experiments with equal scattering lengths. Instead of a linear dependence on relaxation time {tau} for the diffusive mode, we find a divergence at small {tau}. No such effect occurs in Fermi gases.

  5. Dynamics of ferroelectric bis(imidazolium) pentachloroantimonate(III) by means of nuclear magnetic resonance 1H relaxometry and dielectric spectroscopy.

    PubMed

    Piecha-Bisiorek, A; Jakubas, R; Medycki, W; Florek-Wojciechowska, M; Wojciechowski, M; Kruk, D

    2014-05-22

    Some of haloantimonates(III) and halobismuthates(III) are ferroelectric. Bis(imidazolium) pentachloroantimonate(III), (C3N2H5)2SbCl5 (abbreviation: ICA) is the first example of such compounds with a one-dimensional anionic chain which exhibits ferroelectric properties. The relation between the ionic dynamics and network structure and the ferroelectric features is not clear. Here Nuclear Magnetic Resonance (NMR) (1)H spin-lattice relaxation experiments at 25 MHz are reported for ICA in the temperature range of 80 K-360 K, covering ferroelectric-paraelectric and structural phase transitions of the compound occurring at 180 and 342 K, respectively. The relaxation process is biexponential in the whole temperature range indicating two dynamically nonequivalent types of imidazolium cations. Temperature dependences of both relaxation contributions allow for identifying three motional processes. Two of them are cation-specific - i.e. they are attributed to the two types of imidazolium cations, respectively. The third process involves both types of cations, and it is characterized by much lower activation energy. Moreover, the relaxation data (combined with (1)H second moment measurements) show that the ferroelectric-paraelectric phase transition mechanism is governed, to a large extent, by the anionic network arrangement. The NMR studies are complemented by dielectric spectroscopy experiments performed in the vicinity of the Curie temperature, TC = 180 K, to get insight into the mechanism of the ferroelectric-paraelectric phase transition. The dielectric dispersion data show critical slowing down of the macroscopic relaxation time, τ, in ICA when approaching TC from the paraelectric side, indicating an order-disorder type of ferroelectrics.

  6. Thermotropic ionic liquid crystals. II. 1H and 23Na NMR study of the smectic mesophase of molten sodium n-butyrate and sodium isovalerate

    NASA Astrophysics Data System (ADS)

    Bonekamp, J. E.; Eguchi, T.; Plesko, S.; Jonas, J.

    1983-08-01

    The 1H and 23Na NMR studies of smectic ionic mesophases of molten sodium n-butyrate and sodium isovalerate are reported over the temperature range of the stability of the liquid crystalline phases. The 1H spin-lattice relaxation times T1 at ν0=9.2, 24.3, and 60 MHz for the anions of both the systems are interpreted in terms of diffusion intermolecular relaxation mechanism. The predicted anion diffusion coefficients are in agreement with those measured directly by spin-echo technique and indicate that the anion diffuses rapidly. In contrast to the T1 relaxation mechanism the results obtained for the proton relaxation times in the rotating coordinate frame T1ρ indicate that the order-fluctuation relaxation mechanism determines the frequency dispersion of T1ρ. The analysis of the T1ρ data provides an approximate measure of the order parameter S as a function of temperature. Fourier transform spectra of the 23Na transitions show that the electric field gradient (EFG) at the Na+ ion is nonaveraged and of such a strength as to produce a second order quadrupole effect in the spectra of the central transition. From the first-order splitting, the quadrupole coupling constant (QCC) is obtained as a function of temperature. The gradual temperature change of QCC demonstrates that only a single liquid crystalline phase exists over the temperature interval of the stability of the smectic mesophase. Using approximate analysis the correlation time τc for the EFG fluctuation is obtained from the 23Na T1 data for the melts of both sodium n-butyrate and sodium isovalerate.

  7. Investigations of acetaminophen binding to bovine serum albumin in the presence of fatty acid: Fluorescence and 1H NMR studies

    NASA Astrophysics Data System (ADS)

    Bojko, B.; Sułkowska, A.; Maciążek-Jurczyk, M.; Równicka, J.; Sułkowski, W. W.

    2009-04-01

    The binding of acetaminophen to bovine serum albumin (BSA) was studied by the quenching fluorescence method and the proton nuclear magnetic resonance technique ( 1H NMR). For fluorescence measurements 1-anilino-9-naphthalene sulfonate (ANS) hydrophobic probe was used to verify subdomain IIIA as acetaminophen's likely binding site. Three binding sites of acetaminophen in subdomain IIA of bovine serum albumin were found. Quenching constants calculated by the Stern-Volmer modified method were used to estimate the influence of myristic acid (MYR) on the drug binding to the albumin. The influence of [fatty acid]/[albumin] molar ratios on the affinity of the protein towards acetaminophen was described. Changes of chemical shifts and relaxation times of the drug indicated that the presence of MYR inhibits interaction in the AA-albumin complex. It is suggested that the elevated level of fatty acids does not significantly influence the pharmacokinetics of acetaminophen.

  8. (1)H, (13)C and (15)N backbone resonance assignments and dynamic properties of the PDZ tandem of Whirlin.

    PubMed

    Delhommel, Florent; Wolff, Nicolas; Cordier, Florence

    2016-10-01

    Mammals perceive sounds thanks to mechanosensory hair cells located in the inner ear. The stereocilia of these cells are tightly bound together in bundles by a network of cadherins and scaffolding proteins. Stereocilia deflection induces stretching of this network and is responsible for hair cell depolarization that triggers the neuronal message, transducing the mechanical signal into an electric signal transmissible to the brain. Nearly all proteins involved in this mechano-electrical transduction network contain short C-terminal motifs of interaction with PDZ domains (PSD-95, Discs Large, ZO-1). Interestingly only two of these proteins encompass PDZ domains: Harmonin and Whirlin. As our first step towards a comprehensive structural study of Whirlin, we have assigned the (1)H, (13)C and (15)N backbone resonances of a tandem formed by the first two PDZ domains of Whirlin, reported the secondary structure elements of this tandem as predicted by the TALOS+ server and evaluated its dynamics from (15)N relaxation measurements.

  9. Transverse Force on Quarks in DIS

    SciTech Connect

    Burkardt, Matthias

    2009-01-01

    The $x^2$-moment of the twist-3 polarized parton distribution $g_2(x)$ is related to the transverse force acting on the active quark in deep-inelastic scattering off a transversely polarized nucleon immediately after it has absorbed the virtual photon. Lattice calculations of the corresponding matrix element as well as experimental measurements of $g_2(x)$ are used to estimate sign and magnitude of this force. Similarly, the $x^2$-moment of the chirally odd twist-3 unpolarized parton distribution $e(x)$ can be related to the transverse force experienced by a transversely polarized quark ejected from a transversely polarized nucleon.

  10. Transverse Momentum Dependent Distributions in Hard Scattering

    SciTech Connect

    Alexie Prokudin

    2011-05-01

    Transverse Momentum Dependent Distributions (TMDs) describe the spin structure of the proton. At leading twist spin structure of spin-1/2 hadron can be described by 8 TMDs. TMDs reveal three-dimensional distribution of partons inside polarised nucleon. Experimentally these functions can be studied in polarised experiments using Spin Asymmetries in particular Single Spin Asymmetries (SSAs). We discuss transversity that measures distribution of transversely polarised quarks in a transversely polarised nucleon and Sivers distribution function that describes distribution of unpolarised quarks in a transversely polarised nucleon.

  11. Nuclear Spin Relaxation and Molecular Interactions of a Novel Triazolium-Based Ionic Liquid

    SciTech Connect

    Allen, Jesse J; Schneider, Yanika; Kail, Brian W; Luebke, David R; Nulwala, Hunaid; Damodaran, Krishnan

    2013-04-11

    Nuclear spin relaxation, small-angle X-ray scattering (SAXS), and electrospray ionization mass spectrometry (ESI-MS) techniques are used to determine supramolecular arrangement of 3-methyl-1-octyl-4-phenyl-1H-triazol-1,2,3-ium bis(trifluoromethanesulfonyl)imide [OMPhTz][Tf{sub 2}N], an example of a triazolium-based ionic liquid. The results obtained showed first-order thermodynamic dependence for nuclear spin relaxation of the anion. First-order relaxation dependence is interpreted as through-bond dipolar relaxation. Greater than first-order dependence was found in the aliphatic protons, aromatic carbons (including nearest neighbors), and carbons at the end of the aliphatic tail. Greater than first order thermodynamic dependence of spin relaxation rates is interpreted as relaxation resulting from at least one mechanism additional to through-bond dipolar relaxation. In rigid portions of the cation, an additional spin relaxation mechanism is attributed to anisotropic effects, while greater than first order thermodynamic dependence of the octyl side chain’s spin relaxation rates is attributed to cation–cation interactions. Little interaction between the anion and the cation was observed by spin relaxation studies or by ESI-MS. No extended supramolecular structure was observed in this study, which was further supported by MS and SAXS. nuclear Overhauser enhancement (NOE) factors are used in conjunction with spin–lattice relaxation time (T{sub 1}) measurements to calculate rotational correlation times for C–H bonds (the time it takes for the vector represented by the bond between the two atoms to rotate by one radian). The rotational correlation times are used to represent segmental reorientation dynamics of the cation. A combination of techniques is used to determine the segmental interactions and dynamics of this example of a triazolium-based ionic liquid.

  12. Relaxation schemes for Chebyshev spectral multigrid methods

    NASA Technical Reports Server (NTRS)

    Kang, Yimin; Fulton, Scott R.

    1993-01-01

    Two relaxation schemes for Chebyshev spectral multigrid methods are presented for elliptic equations with Dirichlet boundary conditions. The first scheme is a pointwise-preconditioned Richardson relaxation scheme and the second is a line relaxation scheme. The line relaxation scheme provides an efficient and relatively simple approach for solving two-dimensional spectral equations. Numerical examples and comparisons with other methods are given.

  13. NMR Relaxation in Systems with Magnetic Nanoparticles: A Temperature Study

    PubMed Central

    Issa, Bashar; Obaidat, Ihab M.; Hejasee, Rola H.; Qadri, Shahnaz; Haik, Yousef

    2013-01-01

    Purpose To measure and model NMR relaxation enhancement due to the presence of Gd substituted Zn-Mn ferrite magnetic nanoparticles at different temperatures. Materials and Methods Relaxation rates were measured at 1.5 T using FSE sequences in samples of agarose gel doped with uncoated and polyethylene glycol (PEG) coated Mn0.5Zn0.5Gd0.02Fe1.98O4 nanoparticles over the temperature range 8 to 58°C. Physical characterization of the magnetic nanoparticles synthesized using chemical co-precipitation included scanning (SEM) and transmission (TEM) electron microscopy, inductively coupled plasma (ICP), dynamic light scattering (DLS), and magnetometry. Results Relaxivity (in s−1 mM−1 Fe) for the uncoated and coated particles, respectively, increased as follows: from 2.5 to 3.2 and 0.4 to 0.7 for T1, while for T2 it increased from 162.3 to 253.7 and 59.7 to 82.2 over the temperature range 8 to 58°C. T2 data was fitted to the echo limited motional regime using one fitting parameter that reflects the degree of agglomeration of particles into a cluster. This parameter was found to increase linearly with temperature and was larger for the PEG coated particles than the uncoated ones. Conclusion The increase of 1/T2 with temperature is modeled successfully using echo limited motional regime where both diffusion of the protons and nanoparticle cluster size increase with temperature. Both transverse and longitudinal relaxation efficiencies are reduced by PEG coating at all temperatures. If prediction of relaxation rates under different particle concentrations and operating temperatures is possible then the use of MNP in temperature monitoring and hyperthermia applications may be achieved. PMID:23720101

  14. Transverse Echo Measurements in RHIC

    SciTech Connect

    Fischer, Wolfram

    2006-03-20

    Diffusion counteracts cooling and the knowledge of diffusion rates is important for the calculation of cooling times and equilibrium beam sizes. Echo measurements are a potentially sensitive method to determine diffusion rates, and longitudinal measurements were done in a number of machines. We report on transverse echo measurements in RHIC and the observed dependence of echo amplitudes on a number of parameters for beams of gold and copper ions, and protons. In particular we examine the echo amplitudes of gold and copper ion bunches of varying intensity, which exhibit different diffusion rates from intrabeam scattering.

  15. TRANSVERSE ECHO MEASUREMENTS IN RHIC.

    SciTech Connect

    FISCHER, W.

    2005-09-18

    Diffusion counteracts cooling and the knowledge of diffusion rates is important for the calculation of cooling times and equilibrium beam sizes. Echo measurements are a potentially sensitive method to determine diffusion rates, and longitudinal measurements were done in a number of machines. We report on transverse echo measurements in RHIC and the observed dependence of echo amplitudes on a number of parameters for beams of gold and copper ions, and protons. In particular they examine the echo amplitudes of gold and copper ion bunches of varying intensity, which exhibit different diffusion rates from intrabeam scattering.

  16. A Transversely Isotropic Thermoelastic Theory

    NASA Technical Reports Server (NTRS)

    Arnold, S. M.

    1989-01-01

    A continuum theory is presented for representing the thermoelastic behavior of composites that can be idealized as transversely isotropic. This theory is consistent with anisotropic viscoplastic theories being developed presently at NASA Lewis Research Center. A multiaxial statement of the theory is presented, as well as plane stress and plane strain reductions. Experimental determination of the required material parameters and their theoretical constraints are discussed. Simple homogeneously stressed elements are examined to illustrate the effect of fiber orientation on the resulting strain distribution. Finally, the multiaxial stress-strain relations are expressed in matrix form to simplify and accelerate implementation of the theory into structural analysis codes.

  17. Phase transitions in semidefinite relaxations

    PubMed Central

    Javanmard, Adel; Montanari, Andrea; Ricci-Tersenghi, Federico

    2016-01-01

    Statistical inference problems arising within signal processing, data mining, and machine learning naturally give rise to hard combinatorial optimization problems. These problems become intractable when the dimensionality of the data is large, as is often the case for modern datasets. A popular idea is to construct convex relaxations of these combinatorial problems, which can be solved efficiently for large-scale datasets. Semidefinite programming (SDP) relaxations are among the most powerful methods in this family and are surprisingly well suited for a broad range of problems where data take the form of matrices or graphs. It has been observed several times that when the statistical noise is small enough, SDP relaxations correctly detect the underlying combinatorial structures. In this paper we develop asymptotic predictions for several detection thresholds, as well as for the estimation error above these thresholds. We study some classical SDP relaxations for statistical problems motivated by graph synchronization and community detection in networks. We map these optimization problems to statistical mechanics models with vector spins and use nonrigorous techniques from statistical mechanics to characterize the corresponding phase transitions. Our results clarify the effectiveness of SDP relaxations in solving high-dimensional statistical problems. PMID:27001856

  18. Phase transitions in semidefinite relaxations.

    PubMed

    Javanmard, Adel; Montanari, Andrea; Ricci-Tersenghi, Federico

    2016-04-19

    Statistical inference problems arising within signal processing, data mining, and machine learning naturally give rise to hard combinatorial optimization problems. These problems become intractable when the dimensionality of the data is large, as is often the case for modern datasets. A popular idea is to construct convex relaxations of these combinatorial problems, which can be solved efficiently for large-scale datasets. Semidefinite programming (SDP) relaxations are among the most powerful methods in this family and are surprisingly well suited for a broad range of problems where data take the form of matrices or graphs. It has been observed several times that when the statistical noise is small enough, SDP relaxations correctly detect the underlying combinatorial structures. In this paper we develop asymptotic predictions for several detection thresholds, as well as for the estimation error above these thresholds. We study some classical SDP relaxations for statistical problems motivated by graph synchronization and community detection in networks. We map these optimization problems to statistical mechanics models with vector spins and use nonrigorous techniques from statistical mechanics to characterize the corresponding phase transitions. Our results clarify the effectiveness of SDP relaxations in solving high-dimensional statistical problems. PMID:27001856

  19. Quantitative interpretation of the very fast electronic relaxation of most Ln3+ ions in dissolved complexes

    NASA Astrophysics Data System (ADS)

    Fries, Pascal H.; Belorizky, Elie

    2012-02-01

    In a reference frame rigidly bound to the complex, we consider two Hamiltonians possibly at the origin of the very fast electronic relaxation of the paramagnetic lanthanide Ln3+ ions (Ln = Ce to Nd, Tb to Yb), namely the mean (static) ligand-field Hamiltonian and the transient ligand-field Hamiltonian. In the laboratory frame, the bombardment of the complex by solvent molecules causes its Brownian rotation and its vibration-distorsion dynamics governing the fluctuations of the static and transient terms, respectively. These fluctuations are at the origin of electronic relaxation. The electronic relaxation of a Ln3+ ion is defined by the decays of the time correlation functions (TCFs) of the longitudinal and transverse components of the total angular momentum J of its ground multiplet. The Brownian rotation of the complex and its vibration-distorsion dynamics are simulated by random walks, which enable us to compute the TCFs from first principles. It is shown that the electronic relaxation is governed mainly by the magnitude of the transient ligand-field, and not by its particular expression. The range of expected values of this ligand-field together with the lower limit of relaxation time enforced by the values of the vibration-distortion correlation time in liquids give rise to effective electronic relaxation times which are in satisfactory overall agreement with the experimental data. In particular, these considerations explain why the electronic relaxation times vary little with the coordinating ligand and are practically independent of the external field magnitude.

  20. Anisotropic spin relaxation in graphene.

    PubMed

    Tombros, N; Tanabe, S; Veligura, A; Jozsa, C; Popinciuc, M; Jonkman, H T; van Wees, B J

    2008-07-25

    Spin relaxation in graphene is investigated in electrical graphene spin valve devices in the nonlocal geometry. Ferromagnetic electrodes with in-plane magnetizations inject spins parallel to the graphene layer. They are subject to Hanle spin precession under a magnetic field B applied perpendicular to the graphene layer. Fields above 1.5 T force the magnetization direction of the ferromagnetic contacts to align to the field, allowing injection of spins perpendicular to the graphene plane. A comparison of the spin signals at B=0 and B=2 T shows a 20% decrease in spin relaxation time for spins perpendicular to the graphene layer compared to spins parallel to the layer. We analyze the results in terms of the different strengths of the spin-orbit effective fields in the in-plane and out-of-plane directions and discuss the role of the Elliott-Yafet and Dyakonov-Perel mechanisms for spin relaxation. PMID:18764351

  1. Ellipsoidal Relaxation of Deformed Vesicles

    NASA Astrophysics Data System (ADS)

    Yu, Miao; Lira, Rafael B.; Riske, Karin A.; Dimova, Rumiana; Lin, Hao

    2015-09-01

    Theoretical analysis and experimental quantification on the ellipsoidal relaxation of vesicles are presented. The current work reveals the simplicity and universal aspects of this process. The Helfrich formula is shown to apply to the dynamic relaxation of moderate-to-high tension membranes, and a closed-form solution is derived which predicts the vesicle aspect ratio as a function of time. Scattered data are unified by a time scale, which leads to a similarity behavior, governed by a distinctive solution for each vesicle type. Two separate regimes in the relaxation are identified, namely, the "entropic" and the "constant-tension" regimes. The bending rigidity and the initial membrane tension can be simultaneously extracted from the data analysis, posing the current approach as an effective means for the mechanical analysis of biomembranes.

  2. A 15N CPMG relaxation dispersion experiment more resistant to resonance offset and pulse imperfection

    NASA Astrophysics Data System (ADS)

    Jiang, Bin; Yu, Binhan; Zhang, Xu; Liu, Maili; Yang, Daiwen

    2015-08-01

    Carr-Purcell-Meiboom-Gill (CPMG) relaxation dispersion is a powerful NMR method to study protein dynamics on the microsecond-millisecond time scale. J-coupling, resonance offset, radio frequency field inhomogeneity, and pulse imperfection often introduce systematic errors into the measured transverse relaxation rates. Here we proposed a modified continuous wave decoupling CPMG experiment, which is more unaffected by resonance offset and pulse imperfection. We found that it is unnecessary to match the decoupling field strength with the delay between CPMG refocusing pulses, provided that decoupling field is strong enough. The performance of the scheme proposed here was shown by simulations and further demonstrated experimentally on a fatty acid binding protein.

  3. A mixed relaxed clock model.

    PubMed

    Lartillot, Nicolas; Phillips, Matthew J; Ronquist, Fredrik

    2016-07-19

    Over recent years, several alternative relaxed clock models have been proposed in the context of Bayesian dating. These models fall in two distinct categories: uncorrelated and autocorrelated across branches. The choice between these two classes of relaxed clocks is still an open question. More fundamentally, the true process of rate variation may have both long-term trends and short-term fluctuations, suggesting that more sophisticated clock models unfolding over multiple time scales should ultimately be developed. Here, a mixed relaxed clock model is introduced, which can be mechanistically interpreted as a rate variation process undergoing short-term fluctuations on the top of Brownian long-term trends. Statistically, this mixed clock represents an alternative solution to the problem of choosing between autocorrelated and uncorrelated relaxed clocks, by proposing instead to combine their respective merits. Fitting this model on a dataset of 105 placental mammals, using both node-dating and tip-dating approaches, suggests that the two pure clocks, Brownian and white noise, are rejected in favour of a mixed model with approximately equal contributions for its uncorrelated and autocorrelated components. The tip-dating analysis is particularly sensitive to the choice of the relaxed clock model. In this context, the classical pure Brownian relaxed clock appears to be overly rigid, leading to biases in divergence time estimation. By contrast, the use of a mixed clock leads to more recent and more reasonable estimates for the crown ages of placental orders and superorders. Altogether, the mixed clock introduced here represents a first step towards empirically more adequate models of the patterns of rate variation across phylogenetic trees.This article is part of the themed issue 'Dating species divergences using rocks and clocks'.

  4. A mixed relaxed clock model

    PubMed Central

    2016-01-01

    Over recent years, several alternative relaxed clock models have been proposed in the context of Bayesian dating. These models fall in two distinct categories: uncorrelated and autocorrelated across branches. The choice between these two classes of relaxed clocks is still an open question. More fundamentally, the true process of rate variation may have both long-term trends and short-term fluctuations, suggesting that more sophisticated clock models unfolding over multiple time scales should ultimately be developed. Here, a mixed relaxed clock model is introduced, which can be mechanistically interpreted as a rate variation process undergoing short-term fluctuations on the top of Brownian long-term trends. Statistically, this mixed clock represents an alternative solution to the problem of choosing between autocorrelated and uncorrelated relaxed clocks, by proposing instead to combine their respective merits. Fitting this model on a dataset of 105 placental mammals, using both node-dating and tip-dating approaches, suggests that the two pure clocks, Brownian and white noise, are rejected in favour of a mixed model with approximately equal contributions for its uncorrelated and autocorrelated components. The tip-dating analysis is particularly sensitive to the choice of the relaxed clock model. In this context, the classical pure Brownian relaxed clock appears to be overly rigid, leading to biases in divergence time estimation. By contrast, the use of a mixed clock leads to more recent and more reasonable estimates for the crown ages of placental orders and superorders. Altogether, the mixed clock introduced here represents a first step towards empirically more adequate models of the patterns of rate variation across phylogenetic trees. This article is part of the themed issue ‘Dating species divergences using rocks and clocks’. PMID:27325829

  5. Accurate determination of order parameters from 1H,15N dipolar couplings in MAS solid-state NMR experiments.

    PubMed

    Chevelkov, Veniamin; Fink, Uwe; Reif, Bernd

    2009-10-01

    A reliable site-specific estimate of the individual N-H bond lengths in the protein backbone is the fundamental basis of any relaxation experiment in solution and in the solid-state NMR. The N-H bond length can in principle be influenced by hydrogen bonding, which would result in an increased N-H distance. At the same time, dynamics in the backbone induces a reduction of the experimental dipolar coupling due to motional averaging. We present a 3D dipolar recoupling experiment in which the (1)H,(15)N dipolar coupling is reintroduced in the indirect dimension using phase-inverted CP to eliminate effects from rf inhomogeneity. We find no variation of the N-H dipolar coupling as a function of hydrogen bonding. Instead, variations in the (1)H,(15)N dipolar coupling seem to be due to dynamics of the protein backbone. This is supported by the observed correlation between the H(N)-N dipolar coupling and the amide proton chemical shift. The experiment is demonstrated for a perdeuterated sample of the alpha-spectrin SH3 domain. Perdeuteration is a prerequisite to achieve high accuracy. The average error in the analysis of the H-N dipolar couplings is on the order of +/-370 Hz (+/-0.012 A) and can be as small as 150 Hz, corresponding to a variation of the bond length of +/-0.005 A.

  6. Improved specificity of cartilage matrix evaluation using multiexponential transverse relaxation analysis applied to pathomimetically degraded cartilage

    PubMed Central

    Reiter, David A.; Roque, Remigio A.; Lin, Ping-Chang; Doty, Stephen B.; Pleshko, Nancy; Spencer, Richard G.

    2012-01-01

    Noninvasive early detection of specific matrix alterations in degenerative cartilage disease would be of substantial use in basic science studies and clinically, but remains an elusive goal. Recently-developed MRI methods exhibit some specificity, but require contrast agents or nonstandard pulse sequences and hardware. We present a multiexponential approach which does not require contrast agents or specialized hardware, and uses a standard multiple-echo spin-echo sequence. Experiments were performed on tissue models of degenerative cartilage using enzymes with distinct actions. MR results were validated with histologic, biochemical, and infrared spectroscopic analyses. The sulfated glycosaminoglycan (sGAG) per dry weight (dw) in bovine nasal cartilage (BNC) was 0.72±0.06 mg/mg dw and was reduced through chondroitinase AC (ChAC) and collagenase digestion to 0.56±0.12 and 0.58±0.13 mg/mg dw, respectively. Multiexponential analysis of data obtained at 9.4T permitted identification of tissue compartments assigned to the proteoglycan (PG) component of the matrix and to bulk water. Enzymatic treatment resulted in a significant reduction in the ratio of PG-bound to free water from 0.13±0.02 in control cartilage to 0.03±0.02 and 0.05±0.06 under ChAC and collagenase treatment, respectively. As expected, monoexponential T2 increased with both degradation protocols, but without further specificity to the nature of the degradation. An important eventual extension of this approach may be to map articular cartilage degeneration in the clinical setting. As an initial step towards this, localized multiexponential T2 analysis was performed on excised bovine patella. Results obtained on this articular cartilage sample were readily interpretable in terms of PG-associated and relatively free water compartments. In potential clinical applications, SNR constraints will define the threshold for detection of macromolecular compartment changes at a given spatial scale. The multiexponential approach has potential application to the early detection of cartilage degradation with use of appropriate pulse parameters under high SNR conditions. PMID:21465593

  7. Molecular relaxations in amorphous phenylbutazone

    NASA Astrophysics Data System (ADS)

    Sahra, M.; Thayyil, M. Shahin; Capaccioli, S.

    2016-05-01

    Molecular dynamics of phenylbutazone in the supercooled liquid and glassy state is studied using broadband dielectric spectroscopy for test frequencies 1 kHz, 10 kHz and 100 kHz over a wide temperature range. Above the glass transition temperature Tg, the presence of the structural α-relaxation peak was observed which shifts towards lower frequencies as the temperature decreases and kinetically freezes at Tg. Besides the structural α-relaxation peak, a β-process which arises due to the localized molecular fluctuations is observed at lower temperature.

  8. Simple Approaches for Estimating Vicinal 1H- 1H Coupling-Constants and for Obtaining Stereospecific Resonance Assignments in Leucine Side Chains

    NASA Astrophysics Data System (ADS)

    Constantine, K. L.; Friedrichs, M. S.; Mueller, L.

    An approach for deriving stereospecific δ-methyl assignments and χ 2 dihedral angle constraints for leucine residues, based on easily recognized patterns of 1H- 1H spin-spin coupling constants and intraresidue nuclear-Overhauser-effect spectroscopy (NOESY) cross-peak intensities, is described. The approach depends on resolved H γ and/or δ-methyl resonances and on initially obtaining stereospecific assignments for H β2 and H β3. As part of the overall strategy, a method is presented for obtaining qualitative or, in favorable cases, semiquantitative estimates of vicinal 1H- 1H coupling constants from peak intensities measured in a short-mixing-time 1H- 1H total correlation spectroscopy (TOCSY) experiment. This method of estimating 1H- 1H spin-spin coupling constants is generally applicable to all side-chain types. The approach is illustrated for several leucine residues within uniformly 15N-labeled and 15N/ 13C-double-labeled isolated light-chain variable domain of the anti-digoxin antibody 26-10. Estimates of 3Jαβ and 3Jβγ coupling constants are derived from a three-dimensional (3D) 13C-edited TOCSY-heteronuclear multiple-quantum coherence (HMQC) spectrum. These data are combined with information from 3D 15N-edited NOESY and 3D 13C-edited NOESY spectra to yield stereospecific H β2, H β3, and δ-methyl assignments, as well as constraints on χ (1) and χ 2 dihedral angles. Although the overall approach is illustrated using 3D 15N-edited and 13C-edited data, it is equally applicable to analysis of two-dimensional 1H- 1H NOESY and TOCSY spectra.

  9. Direct measurements of protein backbone 15N spin relaxation rates from peak line-width using a fully-relaxed Accordion 3D HNCO experiment.

    PubMed

    Chen, Kang; Tjandra, Nico

    2009-03-01

    Protein backbone (15)N spin relaxation rates measured by solution NMR provide useful dynamic information with a site-specific resolution. The conventional method is to record a series of 2D (1)H-(15)N HSQC spectra with varied relaxation delays, and derive relaxation rate from the following curve fitting on the resonance intensities. Proteins with poorly resolved spectra often require several 3D HNCO spectra to be collected on a (15)N/(13)C double labeled protein sample. In order to reduce the relaxation dimension Carr et al. (P.A. Carr, D.A. Fearing, A.G. Palmer, 3D accordion spectroscopy for measuring N-15 and (CO)-Carbon-13 relaxation rates in poorly resolved NMR spectra, J. Magn. Reson. 132 (1998) 25-33) employed an Accordion type HNCO pulse sequence to obtain (15)N or (13)C T(1) relaxation rates by numerical fitting of the relaxation interfered free induction decay (FID) data. To avoid intensive analysis of the time domain data, we propose a modified protocol to measure (15)N T(1) and T(2) relaxation rates from easily obtained line-widths in an Accordion HNCO spectrum. Both T(1) and T(2) relaxation could be simultaneously convoluted into the constant-time evolution periods of (13)C' and (15)N, respectively. The relaxation delay was allowed to reach at least 3 x T(1) or 3 x T(2) so that the signal was substantially decayed by the end of the FID, and the resulting peak full-width at half height (FWHH) could be directly used to calculate relaxation rate. When applied to the 76-residue Ubiquitin and the 226-residue glutamine-binding protein (GlnBP), this method yielded T(1) and T(2) values deviating on average by 4-6% and 5-7%, respectively, from the measurements based on the conventional 2D method. In comparison, the conventional methods possessed intrinsic error ranges of 2-4% for T(1) and 3-6% for T(2). In addition to comparable accuracy, the fully-relaxed Accordion HNCO method presented here allowed measurements of relaxation rates for resonances unresolved in

  10. 40 CFR 721.10373 - 1H-Imidazole, 1-(1-methylethyl)-.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false 1H-Imidazole, 1-(1-methylethyl)-. 721... Substances § 721.10373 1H-Imidazole, 1-(1-methylethyl)-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as 1H-imidazole, 1-(1-methylethyl)- (PMN...

  11. 40 CFR 721.10373 - 1H-Imidazole, 1-(1-methylethyl)-.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false 1H-Imidazole, 1-(1-methylethyl)-. 721... Substances § 721.10373 1H-Imidazole, 1-(1-methylethyl)-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as 1H-imidazole, 1-(1-methylethyl)- (PMN...

  12. 40 CFR 721.10373 - 1H-Imidazole, 1-(1-methylethyl)-.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false 1H-Imidazole, 1-(1-methylethyl)-. 721... Substances § 721.10373 1H-Imidazole, 1-(1-methylethyl)-. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as 1H-imidazole, 1-(1-methylethyl)- (PMN...

  13. Complete assignments of 1H and 13C NMR data for ten phenylpiperazine derivatives.

    PubMed

    Xiao, Zhihui; Yuan, Mu; Zhang, Si; Wu, Jun; Qi, Shuhua; Li, Qingxin

    2005-10-01

    Ten phenylpiperazine derivatives were designed and synthesized. The first complete assignments of (1)H and (13)C NMR chemical shifts for these phenylpiperazine derivatives were achieved by means of 1D and 2D NMR techniques, including (1)H-(1)H COSY, HSQC and HMBC spectra.

  14. Complete assignments of 1H and 13C NMR data for 10 phenylethanoid glycosides.

    PubMed

    Wu, Jun; Huang, Jianshe; Xiao, Qiang; Zhang, Si; Xiao, Zhihui; Li, Qingxin; Long, Lijuan; Huang, Liangmin

    2004-07-01

    Ten phenylethanoid glycosides, including two new ones, isolated from the aerial parts of the mangrove plant Acanthus ilicifolius were identified. The first complete assignments of the 1H and 13C NMR chemical shifts for these glycosides were achieved by means of 2D NMR techniques, including 1H-1H COSY, TOCSY, HSQC and HMBC spectra.

  15. Comparative Relaxant Effects of Ataciguat and Zaprinast on Sheep Sphincter of Oddi

    PubMed Central

    Çakmak, Erol; Yönem, Özlem; Saraç, Bülent; Parlak, Mesut; Çelik, Cumali; Ataseven, Hilmi; Bağcivan, İhsan

    2016-01-01

    Background: Relaxing the sphincter of Oddi (SO) is an important process during endoscopic retrograde cholangiopancreatography (ERCP) procedures. This issue suggests that the easier the sphincterotomy and cannulation, the more post-ERCP complications decrease. Aims: To compare the relaxant effects of ataciguat (a novel soluble guanylyl cyclase activator) and zaprinast (an inhibitor of phosphodiesterase 5) on sheep SO in vitro, thus testing whether they can be used during ERCP. Study Design: Animal experimentation. Methods: Sheep SO rings were placed in tissue baths and their isometric tension to ataciguat and zaprinast were tested. We also tested their isometric tension against ataciguat in the presence of 1H-(1,2,4) oxadiazole (4,3-a) quinoxalin-1-one (ODQ) which is a soluble guanylyl cyclase inhibitor. Results: Ataciguat and zaprinast both triggered concentration addicted relaxation on sheep SO rings (p=0.0018, p=0.0025 respectively) but the relaxation of the ataciguat was significantly greater than that of zaprinast at all concentrations (p=0.0024). It was observed that decreased relaxation responses were initiated by ataciguat in the presence of ODQ (p=0.0012). Conclusion: Ataciguat and zaprinast both have relaxing effects on sphincter of Oddi, although that of zaprinast is lower. We believe that ataciguat and zaprinast can be used in ERCP procedures in order to relax the sphincter of Oddi and thus can be used locally in order to decrease complications.

  16. Comparative Relaxant Effects of Ataciguat and Zaprinast on Sheep Sphincter of Oddi

    PubMed Central

    Çakmak, Erol; Yönem, Özlem; Saraç, Bülent; Parlak, Mesut; Çelik, Cumali; Ataseven, Hilmi; Bağcivan, İhsan

    2016-01-01

    Background: Relaxing the sphincter of Oddi (SO) is an important process during endoscopic retrograde cholangiopancreatography (ERCP) procedures. This issue suggests that the easier the sphincterotomy and cannulation, the more post-ERCP complications decrease. Aims: To compare the relaxant effects of ataciguat (a novel soluble guanylyl cyclase activator) and zaprinast (an inhibitor of phosphodiesterase 5) on sheep SO in vitro, thus testing whether they can be used during ERCP. Study Design: Animal experimentation. Methods: Sheep SO rings were placed in tissue baths and their isometric tension to ataciguat and zaprinast were tested. We also tested their isometric tension against ataciguat in the presence of 1H-(1,2,4) oxadiazole (4,3-a) quinoxalin-1-one (ODQ) which is a soluble guanylyl cyclase inhibitor. Results: Ataciguat and zaprinast both triggered concentration addicted relaxation on sheep SO rings (p=0.0018, p=0.0025 respectively) but the relaxation of the ataciguat was significantly greater than that of zaprinast at all concentrations (p=0.0024). It was observed that decreased relaxation responses were initiated by ataciguat in the presence of ODQ (p=0.0012). Conclusion: Ataciguat and zaprinast both have relaxing effects on sphincter of Oddi, although that of zaprinast is lower. We believe that ataciguat and zaprinast can be used in ERCP procedures in order to relax the sphincter of Oddi and thus can be used locally in order to decrease complications. PMID:27606143

  17. Transverse-longitudinal integrated resonator

    DOEpatents

    Hutchinson, Donald P [Knoxville, TN; Simpson, Marcus L [Knoxville, TN; Simpson, John T [Knoxville, TN

    2003-03-11

    A transverse-longitudinal integrated optical resonator (TLIR) is disclosed which includes a waveguide, a first and a second subwavelength resonant grating in the waveguide, and at least one photonic band gap resonant structure (PBG) in the waveguide. The PBG is positioned between the first and second subwavelength resonant gratings. An electro-optic waveguide material may be used to permit tuning the TLIR and to permit the TLIR to perform signal modulation and switching. The TLIR may be positioned on a bulk substrate die with one or more electronic and optical devices and may be communicably connected to the same. A method for fabricating a TLIR including fabricating a broadband reflective grating is disclosed. A method for tuning the TLIR's transmission resonance wavelength is also disclosed.

  18. Transverse section radionuclide scanning system

    DOEpatents

    Kuhl, David E.; Edwards, Roy Q.

    1976-01-01

    This invention provides a transverse section radionuclide scanning system for high-sensitivity quantification of brain radioactivity in cross-section picture format in order to permit accurate assessment of regional brain function localized in three-dimensions. High sensitivity crucially depends on overcoming the heretofore known raster type scanning, which requires back and forth detector movement involving dead-time or partial enclosure of the scan field. Accordingly, this invention provides a detector array having no back and forth movement by interlaced detectors that enclose the scan field and rotate as an integral unit around one axis of rotation in a slip ring that continuously transmits the detector data by means of laser emitting diodes, with the advantages that increased amounts of data can be continuously collected, processed and displayed with increased sensitivity according to a suitable computer program.

  19. Gluonic transversity from lattice QCD

    NASA Astrophysics Data System (ADS)

    Detmold, W.; Shanahan, P. E.

    2016-07-01

    We present an exploratory study of the gluonic structure of the ϕ meson using lattice QCD (LQCD). This includes the first investigation of gluonic transversity via the leading moment of the twist-2 double-helicity-flip gluonic structure function Δ (x ,Q2). This structure function only exists for targets of spin J ≥1 and does not mix with quark distributions at leading twist, thereby providing a particularly clean probe of gluonic degrees of freedom. We also explore the gluonic analogue of the Soffer bound which relates the helicity flip and nonflip gluonic distributions, finding it to be saturated at the level of 80%. This work sets the stage for more complex LQCD studies of gluonic structure in the nucleon and in light nuclei where Δ (x ,Q2) is an "exotic glue" observable probing gluons in a nucleus not associated with individual nucleons.

  20. "Stressing" Relaxation in the Classroom.

    ERIC Educational Resources Information Center

    Prager-Decker, Iris

    A rationale is offered for incorporating relaxation training in elementary school classroom activities. Cited are research studies which focus on the reaction of children to stressful life changes and resulting behavioral and physical disorders. A list is given of significant life events which may be factors in causing diseases or misbehavior in…

  1. Theory of nuclear magnetic relaxation

    NASA Technical Reports Server (NTRS)

    Mcconnell, J.

    1983-01-01

    A theory of nuclear magnetic interaction is based on the study of the stochastic rotation operator. The theory is applied explicitly to relaxation by anisotropic chemical shift and to spin-rotational interactions. It is applicable also to dipole-dipole and quadrupole interactions.

  2. Relaxation times estimation in MRI

    NASA Astrophysics Data System (ADS)

    Baselice, Fabio; Caivano, Rocchina; Cammarota, Aldo; Ferraioli, Giampaolo; Pascazio, Vito

    2014-03-01

    Magnetic Resonance Imaging is a very powerful techniques for soft tissue diagnosis. At the present, the clinical evaluation is mainly conducted exploiting the amplitude of the recorded MR image which, in some specific cases, is modified by using contrast enhancements. Nevertheless, spin-lattice (T1) and spin-spin (T2) relaxation times can play an important role in many pathology diagnosis, such as cancer, Alzheimer or Parkinson diseases. Different algorithms for relaxation time estimation have been proposed in literature. In particular, the two most adopted approaches are based on Least Squares (LS) and on Maximum Likelihood (ML) techniques. As the amplitude noise is not zero mean, the first one produces a biased estimator, while the ML is unbiased but at the cost of high computational effort. Recently the attention has been focused on the estimation in the complex, instead of the amplitude, domain. The advantage of working with real and imaginary decomposition of the available data is mainly the possibility of achieving higher quality estimations. Moreover, the zero mean complex noise makes the Least Square estimation unbiased, achieving low computational times. First results of complex domain relaxation times estimation on real datasets are presented. In particular, a patient with an occipital lesion has been imaged on a 3.0T scanner. Globally, the evaluation of relaxation times allow us to establish a more precise topography of biologically active foci, also with respect to contrast enhanced images.

  3. Distributed Relaxation for Conservative Discretizations

    NASA Technical Reports Server (NTRS)

    Diskin, Boris; Thomas, James L.

    2001-01-01

    A multigrid method is defined as having textbook multigrid efficiency (TME) if the solutions to the governing system of equations are attained in a computational work that is a small (less than 10) multiple of the operation count in one target-grid residual evaluation. The way to achieve this efficiency is the distributed relaxation approach. TME solvers employing distributed relaxation have already been demonstrated for nonconservative formulations of high-Reynolds-number viscous incompressible and subsonic compressible flow regimes. The purpose of this paper is to provide foundations for applications of distributed relaxation to conservative discretizations. A direct correspondence between the primitive variable interpolations for calculating fluxes in conservative finite-volume discretizations and stencils of the discretized derivatives in the nonconservative formulation has been established. Based on this correspondence, one can arrive at a conservative discretization which is very efficiently solved with a nonconservative relaxation scheme and this is demonstrated for conservative discretization of the quasi one-dimensional Euler equations. Formulations for both staggered and collocated grid arrangements are considered and extensions of the general procedure to multiple dimensions are discussed.

  4. Ellipsoidal relaxation of electrodeformed vesicles

    NASA Astrophysics Data System (ADS)

    Yu, Miao; Lin, Hao; Lira, Rafael; Dimova, Rumiana; Riske, Karin

    2015-11-01

    Electrodeformation has been extensively applied to investigate the mechanical behavior of vesicles and cells. While the deformation process often exhibits complex behavior and reveals interesting physics, the relaxation process post-pulsation is equally intriguing yet less frequently studied. In this work theoretical analysis and experimental quantification on the ellipsoidal relaxation of vesicles are presented, which reveal the simplicity and universal aspects of this process. The Helfrich formula, which is derived only for equilibrated shapes, is shown to be applicable to dynamic situations such as in relaxation. A closed-form solution is derived which predicts the vesicle aspect ratio as a function of time. Scattered data are unified by a timescale, which leads to a similarity behavior, governed by a distinctive solution for each vesicle type. Two separate regimes in the relaxation are identified, namely, the ``entropic'' and the ``constant-tension'' regime. The bending rigidity and the initial membrane tension can be simultaneously extracted from the data/model analysis, posing the current approach as an effective means for the mechanical analysis of biomembranes.

  5. Relaxation properties in classical diamagnetism.

    PubMed

    Carati, A; Benfenati, F; Galgani, L

    2011-06-01

    It is an old result of Bohr that, according to classical statistical mechanics, at equilibrium a system of electrons in a static magnetic field presents no magnetization. Thus a magnetization can occur only in an out of equilibrium state, such as that produced through the Foucault currents when a magnetic field is switched on. It was suggested by Bohr that, after the establishment of such a nonequilibrium state, the system of electrons would quickly relax back to equilibrium. In the present paper, we study numerically the relaxation to equilibrium in a modified Bohr model, which is mathematically equivalent to a billiard with obstacles, immersed in a magnetic field that is adiabatically switched on. We show that it is not guaranteed that equilibrium is attained within the typical time scales of microscopic dynamics. Depending on the values of the parameters, one has a relaxation either to equilibrium or to a diamagnetic (presumably metastable) state. The analogy with the relaxation properties in the Fermi Pasta Ulam problem is also pointed out.

  6. Relaxation properties in classical diamagnetism

    NASA Astrophysics Data System (ADS)

    Carati, A.; Benfenati, F.; Galgani, L.

    2011-06-01

    It is an old result of Bohr that, according to classical statistical mechanics, at equilibrium a system of electrons in a static magnetic field presents no magnetization. Thus a magnetization can occur only in an out of equilibrium state, such as that produced through the Foucault currents when a magnetic field is switched on. It was suggested by Bohr that, after the establishment of such a nonequilibrium state, the system of electrons would quickly relax back to equilibrium. In the present paper, we study numerically the relaxation to equilibrium in a modified Bohr model, which is mathematically equivalent to a billiard with obstacles, immersed in a magnetic field that is adiabatically switched on. We show that it is not guaranteed that equilibrium is attained within the typical time scales of microscopic dynamics. Depending on the values of the parameters, one has a relaxation either to equilibrium or to a diamagnetic (presumably metastable) state. The analogy with the relaxation properties in the Fermi Pasta Ulam problem is also pointed out.

  7. Dielectric relaxation of 2-ethyl-1-hexanol around the glass transition by thermally stimulated depolarization currents.

    PubMed

    Arrese-Igor, S; Alegría, A; Colmenero, J

    2015-06-01

    We explore new routes for characterizing the Debye-like and α relaxation in 2-ethyl-1-hexanol (2E1H) monoalcohol by using low frequency dielectric techniques including thermally stimulated depolarization current (TSDC) techniques and isothermal depolarization current methods. In this way, we have improved the resolution of the overlapped processes making it possible the analysis of the data in terms of a mode composition as expected for a chain-like response. Furthermore the explored ultralow frequencies enabled to study dynamics at relatively low temperatures close to the glass transition (Tg). Results show, on the one hand, that Debye-like and α relaxation timescales dramatically approach to each other upon decreasing temperature to Tg. On the other hand, the analysis of partial polarization TSDC data confirms the single exponential character of the Debye-like relaxation in 2E1H and rules out the presence of Rouse type modes in the scenario of a chain-like response. Finally, on crossing the glass transition, the Debye-like relaxation shows non-equilibrium effects which are further emphasized by aging treatment and would presumably emerge as a result of the arrest of the structural relaxation below Tg. PMID:26049505

  8. Theory of Transverse Spin and Transverse Structure of the Nucleon

    NASA Astrophysics Data System (ADS)

    Koike, Yuji

    2009-10-01

    Large single transverse spin asymmetries (SSA) observed in various collision processes opened a new window to disentangle QCD dynamics and quark-gluon substructure of the nucleon. Since SSA is a ``naively T-odd'' observable, it can only occur as an interference between the scattering amplitudes which have different complex phases in a time-reversal invariant theory like QCD. A conventional framework for hard inclusive processes, i.e. perturbative QCD in the twist-2 level, can only give rise to a negligible asymmetry and thus can not explain the observed data. Understanding the origin of the large SSAs requires the extention of the framework of the QCD hard processes, and by now QCD mechanisms leading to large SSAs have been clarified in greater detail. These mechanisms based on different perspectives introduce new concepts describing the nucleon structure not present in the conventional parton model, such as ``parton's intrinsic transverse momentum'' and ``multi-parton correlations.'' Precise and unambiguous definition of these ideas requires much more careful theoretical analyses than the twist-2 case, in particular, in connection with the universality of the parton distribution/fragmentation functions, gauge invariance and factorization properties of the cross sections. In the literature, QCD mechanisms for SSAs are often classified into two categories. One is based on the (naively) ``T-odd'' distribution and fragmentation functions in the transverse momentum dependent (TMD) factorization approach. Sivers and Collins functions are typical examples for this one. The other one is based on the twist-3 quark-gluon (more generally, multi-parton such as triple-gluon) correlation functions in the collinear factorization approaches. The former mechanism can describe SSAs in the small-pT region (pTQ) as a leading-twist effect, while the latter one describes SSAs in the large pT region as a twist-3 effect. Both approaches have been applied to study SSAs in various

  9. Complete 1H NMR spectral analysis of ten chemical markers of Ginkgo biloba

    PubMed Central

    Napolitano, José G.; Lankin, David C.; Chen, Shao-Nong; Pauli, Guido F.

    2013-01-01

    The complete and unambiguous 1H NMR assignments of ten marker constituents of Ginkgo biloba are described. The comprehensive 1H NMR profiles (fingerprints) of ginkgolide A, ginkgolide B, ginkgolide C, ginkgolide J, bilobalide, quercetin, kaempferol, isorhamnetin, isoquercetin, and rutin in DMSO-d6 were obtained through the examination of 1D 1H NMR and 2D 1H,1H-COSY data, in combination with 1H iterative Full Spin Analysis (HiFSA). The computational analysis of discrete spin systems allowed a detailed characterization of all the 1H NMR signals in terms of chemical shifts (δH) and spin-spin coupling constants (JHH), regardless of signal overlap and higher order coupling effects. The capability of the HiFSA-generated 1H fingerprints to reproduce experimental 1H NMR spectra at different field strengths was also evaluated. As a result of this analysis, a revised set of 1H NMR parameters for all ten phytoconstituents was assembled. Furthermore, precise 1H NMR assignments of the sugar moieties of isoquercetin and rutin are reported for the first time. PMID:22730238

  10. On the measurement of 15N-{ 1H} nuclear Overhauser effects. 2. Effects of the saturation scheme and water signal suppression

    NASA Astrophysics Data System (ADS)

    Ferrage, Fabien; Reichel, Amy; Battacharya, Shibani; Cowburn, David; Ghose, Ranajeet

    2010-12-01

    Measurement of steady-state 15N-{ 1H} nuclear Overhauser effects forms a cornerstone of most methods to determine protein backbone dynamics from spin-relaxation data, since it is the most reliable probe of very fast motions on the ps-ns timescale. We have, in two previous publications (J. Magn. Reson. 192 (2008) 302-313; J. Am. Chem. Soc. 131 (2009) 6048-6049) reevaluated spin-dynamics during steady-state (or "saturated") and reference experiments, both of which are required to determine the NOE ratio. Here we assess the performance of several windowed and windowless sequences to achieve effective saturation of protons in steady-state experiments. We also evaluate the influence of the residual water signal due to radiation damping on the NOE ratio. We suggest a recipe that allows one to determine steady-state 15N-{ 1H} NOE's without artifacts and with the highest possible accuracy.

  11. Anomalous dielectric relaxation of water confined in graphite oxide

    SciTech Connect

    Yu, Ji; Tian, Yuchen; Gu, Min; Tang, Tong B.

    2015-09-28

    Nonmonotonic thermal dependence of dielectric relaxation of water has been observed in hydrated graphite oxide (GO). Graphite oxide prepared via Hummers method then imbued with specific water contents were characterized, with {sup 13}C and {sup 1}H nuclear magnetic resonance spectroscopies, X-ray photoelectron spectroscopy, ambient- and variable-temperature X-ray diffractometries, as well as thermogravimetric analysis. Pressed pellets provided with either conducting or blocking electrodes yielded dielectric loss, which was shown to originate from dielectric relaxation of the confined water. Three relaxation processes were observed in impedance spectroscopy. Our previous work has identified two different types of water in GO, namely, intercalated water and water in inter-grain voids. P{sub 1} expresses the reorientation of water confined inside inter-grain voids, and P{sub 2}, the rotation of intercalated water molecules confined in interlayers. The present work reveals a new process P{sub 3}, which also relates to intercalated water. It slows down with temperature, and this apparent anomaly is explained by the decrease in water content and consequent narrowing of interlayer spacing in graphite oxide, as confirmed by characterization techniques. The present study should contribute to our understanding of surface water dynamics.

  12. Anomalous dielectric relaxation of water confined in graphite oxide

    NASA Astrophysics Data System (ADS)

    Yu, Ji; Tian, Yuchen; Gu, Min; Tang, Tong B.

    2015-09-01

    Nonmonotonic thermal dependence of dielectric relaxation of water has been observed in hydrated graphite oxide (GO). Graphite oxide prepared via Hummers method then imbued with specific water contents were characterized, with 13C and 1H nuclear magnetic resonance spectroscopies, X-ray photoelectron spectroscopy, ambient- and variable-temperature X-ray diffractometries, as well as thermogravimetric analysis. Pressed pellets provided with either conducting or blocking electrodes yielded dielectric loss, which was shown to originate from dielectric relaxation of the confined water. Three relaxation processes were observed in impedance spectroscopy. Our previous work has identified two different types of water in GO, namely, intercalated water and water in inter-grain voids. P1 expresses the reorientation of water confined inside inter-grain voids, and P2, the rotation of intercalated water molecules confined in interlayers. The present work reveals a new process P3, which also relates to intercalated water. It slows down with temperature, and this apparent anomaly is explained by the decrease in water content and consequent narrowing of interlayer spacing in graphite oxide, as confirmed by characterization techniques. The present study should contribute to our understanding of surface water dynamics.

  13. Equivalent Relaxations of Optimal Power Flow

    SciTech Connect

    Bose, S; Low, SH; Teeraratkul, T; Hassibi, B

    2015-03-01

    Several convex relaxations of the optimal power flow (OPF) problem have recently been developed using both bus injection models and branch flow models. In this paper, we prove relations among three convex relaxations: a semidefinite relaxation that computes a full matrix, a chordal relaxation based on a chordal extension of the network graph, and a second-order cone relaxation that computes the smallest partial matrix. We prove a bijection between the feasible sets of the OPF in the bus injection model and the branch flow model, establishing the equivalence of these two models and their second-order cone relaxations. Our results imply that, for radial networks, all these relaxations are equivalent and one should always solve the second-order cone relaxation. For mesh networks, the semidefinite relaxation and the chordal relaxation are equally tight and both are strictly tighter than the second-order cone relaxation. Therefore, for mesh networks, one should either solve the chordal relaxation or the SOCP relaxation, trading off tightness and the required computational effort. Simulations are used to illustrate these results.

  14. Direct 13C-detection for carbonyl relaxation studies of protein dynamics.

    PubMed

    Pasat, Gabriela; Zintsmaster, John S; Peng, Jeffrey W

    2008-08-01

    We describe a method that uses direct 13C-detection for measuring rotating-frame carbonyl (13CO) relaxation rates to describe protein functional dynamics. Key advantages of method include the following: (i) unique access to 13CO groups that lack a scalar-coupled 15N-1H group; (ii) insensitivity to 15N/1H exchange-broadening that can derail 1H-detected 15N and HNCO methods; (iii) avoidance of artifacts caused by incomplete water suppression. We demonstrate the approach for both backbone and side-chain 13CO groups. Accuracy of the 13C-detected results is supported by their agreement with those obtained from established HNCO-based approaches. Critically, we show that the 13C-detection approach provides access to the 13CO groups of functionally important residues that are invisible via 1H-detected HNCO methods because of exchange-broadening. Hence, the 13C-based method fills gaps inherent in canonical 1H-detected relaxation experiments, and thus provides a novel complementary tool for NMR studies of biomolecular flexibility. PMID:18514001

  15. NMR relaxation induced by iron oxide particles: testing theoretical models

    NASA Astrophysics Data System (ADS)

    Gossuin, Y.; Orlando, T.; Basini, M.; Henrard, D.; Lascialfari, A.; Mattea, C.; Stapf, S.; Vuong, Q. L.

    2016-04-01

    Superparamagnetic iron oxide particles find their main application as contrast agents for cellular and molecular magnetic resonance imaging. The contrast they bring is due to the shortening of the transverse relaxation time T 2 of water protons. In order to understand their influence on proton relaxation, different theoretical relaxation models have been developed, each of them presenting a certain validity domain, which depends on the particle characteristics and proton dynamics. The validation of these models is crucial since they allow for predicting the ideal particle characteristics for obtaining the best contrast but also because the fitting of T 1 experimental data by the theory constitutes an interesting tool for the characterization of the nanoparticles. In this work, T 2 of suspensions of iron oxide particles in different solvents and at different temperatures, corresponding to different proton diffusion properties, were measured and were compared to the three main theoretical models (the motional averaging regime, the static dephasing regime, and the partial refocusing model) with good qualitative agreement. However, a real quantitative agreement was not observed, probably because of the complexity of these nanoparticulate systems. The Roch theory, developed in the motional averaging regime (MAR), was also successfully used to fit T 1 nuclear magnetic relaxation dispersion (NMRD) profiles, even outside the MAR validity range, and provided a good estimate of the particle size. On the other hand, the simultaneous fitting of T 1 and T 2 NMRD profiles by the theory was impossible, and this occurrence constitutes a clear limitation of the Roch model. Finally, the theory was shown to satisfactorily fit the deuterium T 1 NMRD profile of superparamagnetic particle suspensions in heavy water.

  16. NMR relaxation induced by iron oxide particles: testing theoretical models.

    PubMed

    Gossuin, Y; Orlando, T; Basini, M; Henrard, D; Lascialfari, A; Mattea, C; Stapf, S; Vuong, Q L

    2016-04-15

    Superparamagnetic iron oxide particles find their main application as contrast agents for cellular and molecular magnetic resonance imaging. The contrast they bring is due to the shortening of the transverse relaxation time T 2 of water protons. In order to understand their influence on proton relaxation, different theoretical relaxation models have been developed, each of them presenting a certain validity domain, which depends on the particle characteristics and proton dynamics. The validation of these models is crucial since they allow for predicting the ideal particle characteristics for obtaining the best contrast but also because the fitting of T 1 experimental data by the theory constitutes an interesting tool for the characterization of the nanoparticles. In this work, T 2 of suspensions of iron oxide particles in different solvents and at different temperatures, corresponding to different proton diffusion properties, were measured and were compared to the three main theoretical models (the motional averaging regime, the static dephasing regime, and the partial refocusing model) with good qualitative agreement. However, a real quantitative agreement was not observed, probably because of the complexity of these nanoparticulate systems. The Roch theory, developed in the motional averaging regime (MAR), was also successfully used to fit T 1 nuclear magnetic relaxation dispersion (NMRD) profiles, even outside the MAR validity range, and provided a good estimate of the particle size. On the other hand, the simultaneous fitting of T 1 and T 2 NMRD profiles by the theory was impossible, and this occurrence constitutes a clear limitation of the Roch model. Finally, the theory was shown to satisfactorily fit the deuterium T 1 NMRD profile of superparamagnetic particle suspensions in heavy water.

  17. NMR relaxation induced by iron oxide particles: testing theoretical models.

    PubMed

    Gossuin, Y; Orlando, T; Basini, M; Henrard, D; Lascialfari, A; Mattea, C; Stapf, S; Vuong, Q L

    2016-04-15

    Superparamagnetic iron oxide particles find their main application as contrast agents for cellular and molecular magnetic resonance imaging. The contrast they bring is due to the shortening of the transverse relaxation time T 2 of water protons. In order to understand their influence on proton relaxation, different theoretical relaxation models have been developed, each of them presenting a certain validity domain, which depends on the particle characteristics and proton dynamics. The validation of these models is crucial since they allow for predicting the ideal particle characteristics for obtaining the best contrast but also because the fitting of T 1 experimental data by the theory constitutes an interesting tool for the characterization of the nanoparticles. In this work, T 2 of suspensions of iron oxide particles in different solvents and at different temperatures, corresponding to different proton diffusion properties, were measured and were compared to the three main theoretical models (the motional averaging regime, the static dephasing regime, and the partial refocusing model) with good qualitative agreement. However, a real quantitative agreement was not observed, probably because of the complexity of these nanoparticulate systems. The Roch theory, developed in the motional averaging regime (MAR), was also successfully used to fit T 1 nuclear magnetic relaxation dispersion (NMRD) profiles, even outside the MAR validity range, and provided a good estimate of the particle size. On the other hand, the simultaneous fitting of T 1 and T 2 NMRD profiles by the theory was impossible, and this occurrence constitutes a clear limitation of the Roch model. Finally, the theory was shown to satisfactorily fit the deuterium T 1 NMRD profile of superparamagnetic particle suspensions in heavy water. PMID:26933908

  18. Relaxation Models for Glassy Systems

    NASA Astrophysics Data System (ADS)

    Ajay

    In this thesis we explore some models based on constrained dynamics to understand the origin and ubiquity of the stretched exponential relaxation q(t) = exp(-(t/tau)^{ beta}). The first chapter has a pedagogical introduction to this field. Then we explore two models based primarily on constraints to see whether they would exhibit a stretched exponential relaxation. The first is a sliding block type of model based on a child's puzzle which has blocks and vacancies. The blocks can move only when they are nearest neighbor to a vacancy. We simulate random walk of the blocks and explore the relaxation behavior to equilibrium. We obtain three regimes of relaxation. In the short time regime (where the constraints are strong) we see a stretched exponential behavior. The intermediate time regime is best described as a simple random walk and we obtain a power law (with exponent 1/2). The long time behavior is a simple exponential, as expected. We do a Monte Carlo simulation of random walk on a bond-diluted hypercube. The site-diluted version of this model was suggested by Campbell as an explanation of the relaxation behavior seen in spin glasses. We come to it from the perspective of a system which exemplifies only constraints and nothing else (we have hard constraints with {cal H} = 0). We see that the relaxation to equilibrium is exponential for all p >=q 1/2 and below that it is a stretched exponential. In fact, the beta decreases as p decreases and attains a value of 1/4 at the percolation threshold of p = 1/n, where n is the dimensionality of the hypercube. We also do a calculation for determining the probability of connectivity for finite graphs. This demonstrates that the usual numerical results provided in graph theory, which are in the limit of infinite graphs, are not accurate for finite graphs. The final chapter has a conclusion. We also propose a model based on random graphs and percolation for studying sliding block kind of models.

  19. Restricting query relaxation through user constraints

    SciTech Connect

    Gaasterland, T.

    1993-07-01

    This paper describes techniques to restrict and to heuristically control relaxation of deductive database queries. The process of query relaxation provides a user with a means to automatically identify new queries that are related to the user`s original query. However, for large databases, many relaxations may be possible. The methods to control and restrict the relaxation process introduced in this paper focus the relaxation process and make it more efficient. User restrictions over the data base domain may be expressed as user constraints. This paper describes how user constraints can restrict relaxed queries. Also, a set of heuristics based on cooperative answering techniques are presented for controlling the relaxation process. Finally, the interaction of the methods for relaxing queries, processing user constraints, and applying the heuristic rules is described.

  20. Evolution of the helicity and transversity Transverse-Momentum-Dependent parton distributions

    SciTech Connect

    Prokudin, Alexei; Bacchetta, Alessandro

    2013-07-01

    We examine the QCD evolution of the helicity and transversity parton distribution functions when including also their dependence on transverse momentum. Using an appropriate definition of these polarized transverse momentum distributions (TMDs), we describe their dependence on the factorization scale and rapidity cutoff, which is essential for phenomenological applications.

  1. Evolution of the helicity and transversity Transverse-Momentum-Dependent parton distributions

    SciTech Connect

    Prokudin, Alexey; Bacchetta, Alessandro

    2013-10-01

    We examine the QCD evolution of the helicity and transversity parton distribution functions when including also their dependence on transverse momentum. Using an appropriate definition of these polarized transverse momentum distributions (TMDs), we describe their dependence on the factorization scale and rapidity cutoff, which is essential for phenomenological applications.

  2. Unique Backbone-Water Interaction Detected in Sphingomyelin Bilayers with 1H/31P and 1H/13C HETCOR MAS NMR Spectroscopy

    PubMed Central

    Holland, Gregory P.; Alam, Todd M.

    2008-01-01

    Two-dimensional 1H/31P dipolar heteronuclear correlation (HETCOR) magic-angle spinning nuclear magnetic resonance (NMR) is used to investigate the correlation of the lipid headgroup with various intra- and intermolecular proton environments. Cross-polarization NMR techniques involving 31P have not been previously pursued to a great extent in lipid bilayers due to the long 1H-31P distances and high degree of headgroup mobility that averages the dipolar coupling in the liquid crystalline phase. The results presented herein show that this approach is very promising and yields information not readily available with other experimental methods. Of particular interest is the detection of a unique lipid backbone-water intermolecular interaction in egg sphingomyelin (SM) that is not observed in lipids with glycerol backbones like phosphatidylcholines. This backbone-water interaction in SM is probed when a mixing period allowing magnetization exchange between different 1H environments via the nuclear Overhauser effect (NOE) is included in the NMR pulse sequence. The molecular information provided by these 1H/31P dipolar HETCOR experiments with NOE mixing differ from those previously obtained by conventional NOE spectroscopy and heteronuclear NOE spectroscopy NMR experiments. In addition, two-dimensional 1H/13C INEPT HETCOR experiments with NOE mixing support the 1H/31P dipolar HETCOR results and confirm the presence of a H2O environment that has nonvanishing dipolar interactions with the SM backbone. PMID:18390621

  3. Proton-detected 3D (15)N/(1)H/(1)H isotropic/anisotropic/isotropic chemical shift correlation solid-state NMR at 70kHz MAS.

    PubMed

    Pandey, Manoj Kumar; Yarava, Jayasubba Reddy; Zhang, Rongchun; Ramamoorthy, Ayyalusamy; Nishiyama, Yusuke

    2016-01-01

    Chemical shift anisotropy (CSA) tensors offer a wealth of information for structural and dynamics studies of a variety of chemical and biological systems. In particular, CSA of amide protons can provide piercing insights into hydrogen-bonding interactions that vary with the backbone conformation of a protein and dynamics. However, the narrow span of amide proton resonances makes it very difficult to measure (1)H CSAs of proteins even by using the recently proposed 2D (1)H/(1)H anisotropic/isotropic chemical shift (CSA/CS) correlation technique. Such difficulties due to overlapping proton resonances can in general be overcome by utilizing the broad span of isotropic chemical shifts of low-gamma nuclei like (15)N. In this context, we demonstrate a proton-detected 3D (15)N/(1)H/(1)H CS/CSA/CS correlation experiment at fast MAS frequency (70kHz) to measure (1)H CSA values of unresolved amide protons of N-acetyl-(15)N-l-valyl-(15)N-l-leucine (NAVL).

  4. Plasmon-mediated energy relaxation in graphene

    NASA Astrophysics Data System (ADS)

    Ferry, D. K.; Somphonsane, R.; Ramamoorthy, H.; Bird, J. P.

    2015-12-01

    Energy relaxation of hot carriers in graphene is studied at low temperatures, where the loss rate may differ significantly from that predicted for electron-phonon interactions. We show here that plasmons, important in the relaxation of energetic carriers in bulk semiconductors, can also provide a pathway for energy relaxation in transport experiments in graphene. We obtain a total loss rate to plasmons that results in energy relaxation times whose dependence on temperature and density closely matches that found experimentally.

  5. Plasmon-mediated energy relaxation in graphene

    SciTech Connect

    Ferry, D. K.; Somphonsane, R.; Ramamoorthy, H.; Bird, J. P.

    2015-12-28

    Energy relaxation of hot carriers in graphene is studied at low temperatures, where the loss rate may differ significantly from that predicted for electron-phonon interactions. We show here that plasmons, important in the relaxation of energetic carriers in bulk semiconductors, can also provide a pathway for energy relaxation in transport experiments in graphene. We obtain a total loss rate to plasmons that results in energy relaxation times whose dependence on temperature and density closely matches that found experimentally.

  6. Cladding For Transversely-Pumped Laser Rod

    NASA Technical Reports Server (NTRS)

    Byer, Robert L.; Fan, Tso Yee

    1989-01-01

    Combination of suitable dimensioning and cladding of neodymium:yttrium aluminum garnet of similar solid-state laser provides for more efficient utilization of transversely-incident pump light from diode lasers. New design overcomes some of limitations of longitudinal- and older transverse-pumping concepts and promotes operation at higher output powers in TEM00 mode.

  7. Transverse instability at the recycler ring

    SciTech Connect

    Ng, K.Y.; /Fermilab

    2004-10-01

    Sporadic transverse instabilities have been observed at the Fermilab Recycler Ring leading to increase in transverse emittances and beam loss. The driving source of these instabilities has been attributed to the resistive-wall impedance with space-charge playing an important role in suppressing Landau damping. Growth rates of the instabilities are computed. Remaining problems are discussed.

  8. Viscoelastic Relaxation of Lunar Basins

    NASA Astrophysics Data System (ADS)

    Mohit, P. S.; Phillips, R. J.

    2004-12-01

    The large lunar impact basins provide a unique glimpse into early lunar history. Here we investigate the possibility that the relief of the oldest lunar basins (with the exception of South-Pole Aitken) has decayed through viscous relaxation. We identify nine ancient multi-ring basins with very low relief and low-amplitude Bouguer and free-air gravity anomalies. The characteristics of these basins are consistent with either 1) relaxation of topographic relief by ductile flow (e.g. Solomon et al., 1982) or 2) obliteration of basin topography during crater collapse immediately following impact. Both scenarios require that the basins formed early in lunar history, when the Moon was hot. The latter possibility appears to be unlikely due to the great topographic relief of South Pole-Aitken basin (SPA), the largest and oldest impact basin on the Moon (with the possible exception of the putative Procellarum basin; Wilhelms, 1987). On the other hand, the thin crust beneath SPA may not have allowed ductile flow in its lower portions, even for a hot Moon, implying that a thicker crust is required beneath other ancient basins for the hypothesis of viscous relaxation to be tenable. Using a semi-analytic, self-gravitating viscoelastic model, we investigate the conditions necessary to produce viscous relaxation of lunar basins. We model topographic relaxation for a crustal thickness of 30 km, using a dry diabase flow law for the crust and dry olivine for the mantle. We find that the minimum temperature at the base of the crust (Tb) permitting nearly complete relaxation of topography by ductile flow on a timescale < 108 yrs is 1400 K, corresponding to a heat flow of 55mW/m2, into the crust. Ductile flow in the lower crust becomes increasingly difficult as the crustal thickness decreases. The crust beneath SPA, thinned by the impact, is only 15-20 km thick and would require Tb ≥ 1550 K for relaxation to occur. The fact that SPA has maintained high-amplitude relief suggests that

  9. Kinetic activation-relaxation technique.

    PubMed

    Béland, Laurent Karim; Brommer, Peter; El-Mellouhi, Fedwa; Joly, Jean-François; Mousseau, Normand

    2011-10-01

    We present a detailed description of the kinetic activation-relaxation technique (k-ART), an off-lattice, self-learning kinetic Monte Carlo (KMC) algorithm with on-the-fly event search. Combining a topological classification for local environments and event generation with ART nouveau, an efficient unbiased sampling method for finding transition states, k-ART can be applied to complex materials with atoms in off-lattice positions or with elastic deformations that cannot be handled with standard KMC approaches. In addition to presenting the various elements of the algorithm, we demonstrate the general character of k-ART by applying the algorithm to three challenging systems: self-defect annihilation in c-Si (crystalline silicon), self-interstitial diffusion in Fe, and structural relaxation in a-Si (amorphous silicon).

  10. Models of violently relaxed galaxies

    NASA Astrophysics Data System (ADS)

    Merritt, David; Tremaine, Scott; Johnstone, Doug

    1989-02-01

    The properties of spherical self-gravitating models derived from two distribution functions that incorporate, in a crude way, the physics of violent relaxation are investigated. The first distribution function is identical to the one discussed by Stiavelli and Bertin (1985) except for a change in the sign of the 'temperature', i.e., e exp(-aE) to e exp(+aE). It is shown that these 'negative temperature' models provide a much better description of the end-state of violent relaxation than 'positive temperature' models. The second distribution function is similar to the first except for a different dependence on angular momentum. Both distribution functions yield single-parameter families of models with surface density profiles very similar to the R exp 1/4 law. Furthermore, the central concentration of models in both families increases monotonically with the velocity anisotropy, as expected in systems that formed through cold collapse.

  11. Localized relaxation in stabilized zirconia

    NASA Astrophysics Data System (ADS)

    Ohta, M.; Kirimoto, K.; Nobugai, K.; Wigmore, J. K.; Miyasato, T.

    2002-05-01

    Stabilized zirconia is well known for long-range transport of oxygen ions which is caused by diffusion relaxation of oxygen vacancies. We used torsional vibrations to measure the temperature dependence of internal friction in yttria-stabilized zirconia (YSZ) doped with 9.5 mol% Y 2O 3 and calcia-stabilized zirconia (CSZ) doped with 12 mol% CaO. In the temperature range 300- 700 K, the internal friction peak exhibits anisotropy, different in YSZ from CSZ, which we attribute to localized relaxation of oxygen vacancies. The results imply that some oxygen vacancies are bound within the local structure, a greater number in CSZ than in YSZ, and suggest that the defect symmetry of local structure depends on the type of dopant ion.

  12. Mechanisms of relaxations of bovine isolated bronchioles by the nitric oxide donor, GEA 3175

    PubMed Central

    Hernández, Medardo; Elmedal, Britt; Mulvany, Michael J; Simonsen, Ulf

    1998-01-01

    The present study was designed to investigate the effects and mechanisms of relaxation induced by the nitric oxide (NO) donor, GEA 3175 (a 3-aryl-substituted oxatriazole derivative) on bovine bronchioles (effective lumen diameter 200–800 μm) suspended in microvascular myographs for isometric tension recording. In segments of bovine bronchioles contracted to 5-hydroxytryptamine, GEA 3175 (10−8–10−4 M) induced concentration-dependent reproducible relaxations. These relaxations were slow in onset compared to other NO-donors such as 3-morpholinosydonimine-hydrochloride (SIN-1) and S-nitroso-N-acetylpenicillamine (SNAP). In 5-hydroxytryptamine-contracted preparations the order of relaxant potency (pD2) was: salbutamol (7.80)>GEA 3175 (6.18)>SIN-1 (4.90)>SNAP (3.55). In segments contracted to acetylcholine, the relaxant responses were reduced and GEA 3175 relaxed the bronchioles with pD2=4.41±0.12 and relaxations of 66±10% (n=4), while SNAP and salbutamol caused relaxations of 19±6% (n=4) and 27±6% (n=8) at the highest concentration used, respectively. Oxyhaemoglobin (10−5 M), the scavenger of nitric oxide, caused rightward shifts of the concentration-relaxation curves to GEA 3175 and NO. 1H-[1,2,4]oxadiazolo[4,3,-a]quinoxalin-1-one (ODQ, 3×10−6 M) and LY 83583 (10−6 M), the inhibitors of soluble guanylate cyclase, also reduced the relaxations induced by GEA 3175 and nitric oxide. However, ODQ did not affect salbutamol-evoked relaxation in the bovine small bronchioles. GEA 3175-induced relaxations were reduced in potassium-rich (60 mmol l−1 K+) solution. Glibenclamide (10−6 M) markedly inhibited the relaxations induced by the opener of ATP-sensitive K+ channels, levcromakalim (3×10−8–10−5 M), but it did not modify the relaxations induced by GEA 3175 or salbutamol. Apamin (5×10−7 M), a blocker of the small Ca2+-activated K+-channels did not affect the relaxations to GEA 3175. In contrast, blockers of large Ca2

  13. Recent COMPASS Results on Transverse Physics

    SciTech Connect

    Iwata, Takahiro; Collaboration: COMPASS Collaboration

    2011-12-14

    The investigation of transverse spin and transverse momentum dependent effects in deep inelastic scattering of muons off nucleons is one of the key physics programs of the COMPASS collaboration at CERN. We have investigated the effects from the data obtained with a polarized proton target. In order to access the transversity distribution function, following channels have been analyzed: The azimuthal distribution of single hadrons, the azimuthal dependence of the plane containing hadron pairs, and the measurement of the transverse polarization of lambda hyperons in the final state. The Sivers distribution function which is one of the transverse momentum dependent functions has been investigated also from the azimuthal distribution of single hadrons. Azimuthal asymmetries in unpolarized deep inelastic scattering give important information on the inner structure of the nucleon to access the so-far unmeasured Boer-Mulders function. We have measured these asymmetries using spin-averaged {sup 6}L{sub i}D.

  14. Transverse Spin Effects in SIDIS at COMPASS

    SciTech Connect

    Joosten, Rainer

    2009-12-17

    The measurement of single spin asymmetries in semi-inclusive deep-inelastic scattering (SIDIS) on a transversely polarized target is an important part of the COMPASS physics program. It allows us to investigate the transversity distribution functions as well as transverse momentum dependent distribution functions by measuring azimuthal asymmetries in the hadron production. After COMPASS took data in the years 2002-2004 by scattering a 160 GeV/c muon beam off a transversely polarized deuteron ({sup 6}LiD) target, in 2007 additional data was collected on a transversely polarized proton (NH{sub 3}) target. In this contribution, the latest results on the Collins and Sivers asymmetries in single hadron production as well as two-hadron asymmetries from the analysis of the proton data are presented and compared with existing model predictions.

  15. Recent COMPASS Results on Transverse Physics

    NASA Astrophysics Data System (ADS)

    Iwata, Takahiro

    2011-12-01

    The investigation of transverse spin and transverse momentum dependent effects in deep inelastic scattering of muons off nucleons is one of the key physics programs of the COMPASS collaboration at CERN. We have investigated the effects from the data obtained with a polarized proton target. In order to access the transversity distribution function, following channels have been analyzed: The azimuthal distribution of single hadrons, the azimuthal dependence of the plane containing hadron pairs, and the measurement of the transverse polarization of lambda hyperons in the final state. The Sivers distribution function which is one of the transverse momentum dependent functions has been investigated also from the azimuthal distribution of single hadrons. Azimuthal asymmetries in unpolarized deep inelastic scattering give important information on the inner structure of the nucleon to access the so-far unmeasured Boer-Mulders function. We have measured these asymmetries using spin-averaged 6LiD.

  16. Relaxation: A Fourth "R" for Education.

    ERIC Educational Resources Information Center

    Frederick, A. B.

    Relaxation training helps the individual handle tension through concentrating upon efficient use of muscles. A program of progressive relaxation can be easily incorporated into elementary and secondary schools. Objectives of such a program include the following: (a) to learn to relax technically for purposes of complete rest (deep muscle…

  17. Dynamic Relaxation of Financial Indices

    NASA Astrophysics Data System (ADS)

    Shen, J.; Zheng, B.; Lin, H.; Qiu, T.

    The dynamic relaxation of the German DAX both before and after a large price-change is investigated. The dynamic behavior is characterized by a power law. At the minutely time scale, the exponent p governing the power-law behavior takes a same value before and after the large price change, while at the daily time scale, it is different. Numerical simulations of an interacting EZ herding model are performed for comparison.

  18. Shear Relaxations of Confined Liquids.

    NASA Astrophysics Data System (ADS)

    Carson, George Amos, Jr.

    Ultrathin (<40 A) films of octamethylcyclotetrasiloxane (OMCTS), hexadecane, and dodecane were subjected to linear and non-linear oscillatory shear between flat plates. Shearing frequencies of 0.1 to 800 s^{-1} were applied at pressures from zero to 0.8 MPa using a surface rheometer only recently developed. In most cases the plates were atomically smooth mica surfaces; the role of surface interactions was examined by replacing these with alkyl chain monolayers. OMCTS and hexadecane were examined at a temperature about 5 Celsius degrees above their melting points and tended to solidify. Newtonian plateaus having enormous viscosities were observed at low shear rates. The onset of shear thinning implied relaxation times of about 0.1 s in the linear structure of the confined liquids. Large activation volumes (~80 nm ^3) suggested that shear involved large-scale collective motion. Dodecane was studied at a much higher temperature relative to its melting point and showed no signs of impending solidification though it exhibited well-defined regions of Newtonian response and power law shear thinning. When treated with molecular sieves before use, dodecane had relaxation times which were short (0.02 s) compared to hexadecane, but still exhibited large-scale collective motion. When treated with silica gel, an unexplained long -time relaxation (10 s) was seen in the Newtonian viscosity of dodecane. The relaxation time of the linear structure, 0.005 s was very small, and the storage modulus was unresolvable. The small activation volume (7nm^3) indicated a much lower level of collective motion. The activation volume remained small when dodecane was confined between tightly bound, low energy, alkyl monolayers. At low strains the storage and loss moduli became very large (>10^4 Pa), probably due to interactions with flaws in the monolayers. Dramatic signs of wall slip were observed at large strains even at low pressures.

  19. Characteristics and frequency of transient relaxations of the lower esophageal sphincter in patients with reflux esophagitis.

    PubMed

    Mittal, R K; McCallum, R W

    1988-09-01

    Electromyogram of the submental muscles, esophageal manometry, and pH studies were simultaneously performed in an unselected group of 12 patients with subjective and objective evidence of gastroesophageal reflux (GER) disease to determine the frequency of transient relaxation of the lower esophageal sphincter (LES) and mechanisms of GER. Findings from these patients were compared with data from 10 asymptomatic healthy volunteers. Recordings were obtained for 1 h in the fasting state and 3 h after a standard 850-kcal meal. Transient relaxation of the LES was the only mechanism of acid reflux in normal subjects and accounted for 73.0% of the episodes of acid reflux in patients with GER disease. In both normal subjects and patients with GER, a large number of transient relaxations were associated at their onset with an attenuated submental EMG complex, a small pharyngeal contraction, and an esophageal contraction. The incidences of these associated events were similar in the two study populations. The frequency of transient relaxation of the LES in patients with GER was identical to that of controls. The frequency did not differ even in 9 patients with GER disease who had endoscopic esophagitis. Thirty-six percent of transient relaxations in the normal subjects were accompanied by pH evidence of reflux, but in the GER patients with endoscopic esophagitis 65% of the transient LES relaxations resulted in a reflux event. Acid reflux at the moment of deep inspiration was the second most common mechanism of GER in our patients. Four patients who demonstrated this mechanism had hiatal hernias and more severe esophagitis than the rest of the group. Our findings confirm that transient relaxation of the LES is the major mechanism of GER in patients with reflux esophagitis. However, the similar frequency of this relaxation in GER patients and in healthy asymptomatic subjects suggests that factors other than transient LES relaxation play an important role in the pathogenesis of

  20. Electrodeposited, Transverse Nanowire Electroluminescent Junctions.

    PubMed

    Qiao, Shaopeng; Xu, Qiang; Dutta, Rajen K; Le Thai, Mya; Li, Xiaowei; Penner, Reginald M

    2016-09-27

    The preparation by electrodeposition of transverse nanowire electroluminescent junctions (tn-ELJs) is described, and the electroluminescence (EL) properties of these devices are characterized. The lithographically patterned nanowire electrodeposition process is first used to prepare long (millimeters), linear, nanocrystalline CdSe nanowires on glass. The thickness of these nanowires along the emission axis is 60 nm, and the width, wCdSe, along the electrical axis is adjustable from 100 to 450 nm. Ten pairs of nickel-gold electrical contacts are then positioned along the axis of this nanowire using lithographically directed electrodeposition. The resulting linear array of nickel-CdSe-gold junctions produces EL with an external quantum efficiency, EQE, and threshold voltage, Vth, that depend sensitively on wCdSe. EQE increases with increasing electric field and also with increasing wCdSe, and Vth also increases with wCdSe and, therefore, the electrical resistance of the tn-ELJs. Vth down to 1.8(±0.2) V (for wCdSe ≈ 100 nm) and EQE of 5.5(±0.5) × 10(-5) (for wCdSe ≈ 450 nm) are obtained. tn-ELJs produce a broad EL emission envelope, spanning the wavelength range from 600 to 960 nm.

  1. Spin relaxation in metallic ferromagnets

    NASA Astrophysics Data System (ADS)

    Berger, L.

    2011-02-01

    The Elliott theory of spin relaxation in metals and semiconductors is extended to metallic ferromagnets. Our treatment is based on the two-current model of Fert, Campbell, and Jaoul. The d→s electron-scattering process involved in spin relaxation is the inverse of the s→d process responsible for the anisotropic magnetoresistance (AMR). As a result, spin-relaxation rate 1/τsr and AMR Δρ are given by similar formulas, and are in a constant ratio if scattering is by solute atoms. Our treatment applies to nickel- and cobalt-based alloys which do not have spin-up 3d states at the Fermi level. This category includes many of the technologically important magnetic materials. And we show how to modify the theory to apply it to bcc iron-based alloys. We also treat the case of Permalloy Ni80Fe20 at finite temperature or in thin-film form, where several kinds of scatterers exist. Predicted values of 1/τsr and Δρ are plotted versus resistivity of the sample. These predictions are compared to values of 1/τsr and Δρ derived from ferromagnetic-resonance and AMR experiments in Permalloy.

  2. Arresting relaxation in Pickering Emulsions

    NASA Astrophysics Data System (ADS)

    Atherton, Tim; Burke, Chris

    2015-03-01

    Pickering emulsions consist of droplets of one fluid dispersed in a host fluid and stabilized by colloidal particles absorbed at the fluid-fluid interface. Everyday materials such as crude oil and food products like salad dressing are examples of these materials. Particles can stabilize non spherical droplet shapes in these emulsions through the following sequence: first, an isolated droplet is deformed, e.g. by an electric field, increasing the surface area above the equilibrium value; additional particles are then adsorbed to the interface reducing the surface tension. The droplet is then allowed to relax toward a sphere. If more particles were adsorbed than can be accommodated by the surface area of the spherical ground state, relaxation of the droplet is arrested at some non-spherical shape. Because the energetic cost of removing adsorbed colloids exceeds the interfacial driving force, these configurations can remain stable over long timescales. In this presentation, we present a computational study of the ordering present in anisotropic droplets produced through the mechanism of arrested relaxation and discuss the interplay between the geometry of the droplet, the dynamical process that produced it, and the structure of the defects observed.

  3. Mechanistic Assessment of PD-1H Coinhibitory Receptor-Induced T Cell Tolerance to Allogeneic Antigens.

    PubMed

    Flies, Dallas B; Higuchi, Tomoe; Chen, Lieping

    2015-06-01

    PD-1H is a recently identified cell surface coinhibitory molecule of the B7/CD28 immune modulatory gene family. We showed previously that single injection of a PD-1H agonistic mAb protected mice from graft-versus-host disease (GVHD). In this study, we report two distinct mechanisms operate in PD-1H-induced T cell tolerance. First, signaling via PD-1H coinhibitory receptor potently arrests alloreactive donor T cells from activation and expansion in the initiation phase. Second, donor regulatory T cells are subsequently expanded to maintain long-term tolerance and GVHD suppression. Our study reveals the crucial function of PD-1H as a coinhibitory receptor on alloreactive T cells and its function in the regulation of T cell tolerance. Therefore, PD-1H may be a target for the modulation of alloreactive T cells in GVHD and transplantation. PMID:25917101

  4. Effects of Various Forms of Relaxation Training on Physiological and Self-Report Measures of Relaxation

    ERIC Educational Resources Information Center

    Reinking, Richard H.; Kohl, Marilyn L.

    1975-01-01

    Examines relative effectiveness of four types of relaxation training including Jacobson-Wolpe and electromyograph (EMG) feedback. Dependent measures are EMG recordings and self-report measures of relaxation. All groups reported increased relaxation, but EMG groups were superior in EMG measures of speed of learning and depth of relaxation.…

  5. Relation between Direct Observation of Relaxation and Self-Reported Mindfulness and Relaxation States

    ERIC Educational Resources Information Center

    Hites, Lacey S.; Lundervold, Duane A.

    2013-01-01

    Forty-four individuals, 18-47 (MN 21.8, SD 5.63) years of age, took part in a study examining the magnitude and direction of the relationship between self-report and direct observation measures of relaxation and mindfulness. The Behavioral Relaxation Scale (BRS), a valid direct observation measure of relaxation, was used to assess relaxed behavior…

  6. Time-delay signatures in multi-transverse mode VCSELs subject to double-cavity polarization-rotated optical feedback

    NASA Astrophysics Data System (ADS)

    Lin, Hong; Khurram, Aliza; Hong, Yanhua

    2016-10-01

    Time delay (TD) signatures are studied experimentally in orthogonal polarizations and in individual transverse modes respectively in a VCSEL operating with three transverse modes. Different types of concealment of the TD signatures are observed when the polarization of feedback is rotated through large angles. Effects of feedback strength and external cavity length on the TD signatures are investigated. Weak feedback leads to better concealment of the TD signatures in the dominant polarization. When the round-trip time difference between the two external cavities is close to a half of the relaxation oscillation period, the TD signatures are minimized.

  7. Organometallic 3-(1H-Benzimidazol-2-yl)-1H-pyrazolo[3,4-b]pyridines as Potential Anticancer Agents

    PubMed Central

    2011-01-01

    Six organometallic complexes of the general formula [MIICl(η6-p-cymene)(L)]Cl, where M = Ru (11a, 12a, 13a) or Os (11b, 12b, 13b) and L = 3-(1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-b]pyridines (L1–L3) have been synthesized. The latter are known as potential cyclin-dependent kinase (Cdk) inhibitors. All compounds have been comprehensively characterized by elemental analysis, one- and two-dimensional NMR spectroscopy, UV–vis spectroscopy, ESI mass spectrometry, and X-ray crystallography (11b and 12b). The multistep synthesis of 3-(1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-b]pyridines (L1–L3), which was reported by other researchers, has been modified by us essentially (e.g., the synthesis of 5-bromo-1H-pyrazolo[3,4-b]pyridine-3-carboxylic acid (3) via 5-bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine (2); the synthesis of 1-methoxymethyl-2,3-diaminobenzene (5) by avoiding the use of unstable 2,3-diaminobenzyl alcohol; and the activation of 1H-pyrazolo[3,4-b]pyridine-3-carboxylic acids (1, 3) through the use of an inexpensive coupling reagent, N,N′-carbonyldiimidazole (CDI)). Stabilization of the 7b tautomer of methoxymethyl-substituted L3 by coordination to a metal(II) center, as well as the NMR spectroscopic characterization of two tautomers 7b-L3 and 4b′-L3 in a metal-free state are described. Structure–activity relationships with regard to cytotoxicity and cell cycle effects in human cancer cells, as well as Cdk inhibitory activity, are also reported. PMID:22032295

  8. Dynamics of Glass Relaxation at Room Temperature

    NASA Astrophysics Data System (ADS)

    Welch, Roger C.; Smith, John R.; Potuzak, Marcel; Guo, Xiaoju; Bowden, Bradley F.; Kiczenski, T. J.; Allan, Douglas C.; King, Ellyn A.; Ellison, Adam J.; Mauro, John C.

    2013-06-01

    The problem of glass relaxation under ambient conditions has intrigued scientists and the general public for centuries, most notably in the legend of flowing cathedral glass windows. Here we report quantitative measurement of glass relaxation at room temperature. We find that Corning® Gorilla® Glass shows measurable and reproducible relaxation at room temperature. Remarkably, this relaxation follows a stretched exponential decay rather than simple exponential relaxation, and the value of the stretching exponent (β=3/7) follows a theoretical prediction made by Phillips for homogeneous glasses.

  9. Distinguishing spin relaxation mechanisms in organic semiconductors.

    PubMed

    Harmon, N J; Flatté, M E

    2013-04-26

    A theory is introduced for spin relaxation and spin diffusion of hopping carriers in a disordered system. For disorder described by a distribution of waiting times between hops (e.g., from multiple traps, site-energy disorder, and/or positional disorder) the dominant spin relaxation mechanisms in organic semiconductors (hyperfine, hopping-induced spin-orbit, and intrasite spin relaxation) each produce different characteristic spin relaxation and spin diffusion dependences on temperature. The resulting unique experimental signatures predicted by the theory for each mechanism in organic semiconductors provide a prescription for determining the dominant spin relaxation mechanism. PMID:23679752

  10. 1H and 19F NMR studies on molecular motions and phase transitions in solid triethylammonium tetrafluoroborate

    NASA Astrophysics Data System (ADS)

    Ono, Hiroshi; Seki, Riki; Ikeda, Ryuichi; Ishida, Hiroyuki

    1995-02-01

    Measurements by differential thermal analysis and differential scanning calorimetry and of the spin-lattice relaxation time ( T1), the spin-spin relaxation time ( T2), and the second moment ( M2) of 1H and 19F NMR were carried out in the three solid phases of (CH 3CH 2) 3NHBF 4. X-ray powder patterns were taken in the highest-temperature phase (Phase I) existing above 367 K and the room-temperature phase (Phase II) stable between 220 and 367 K. Phase I formed a NaCl-type cubic structure with a = 11.65(3) Å, Z = 4, V = 1581(13) Å3, and Dx = 0.794 g cm -3, and was expected to be an ionic plastic phase. In this phase, the self-diffusion of anions and the isotropic reorientation of cations were observed. Phase II formed a tetragonal structure with a = 12.47(1) and c = 9.47(3) Å, Z = 4, V = 1473(6) Å3, and Dx = 0.852 g cm -3. From the present DSC and NMR results in this phase, the cations and/or anions were considered to be dynamically disordered states. The C3 reorientation of the cation about the NH bond axis was detected and, in addition, the onset of nutation of the cations and local diffusion of the anions was suggested. In the low-temperature phase (Phase III) stable below 219 K, the C3 reorientations of the three methyl groups of cations and the isotropic reorientation of anions were observed. The motional parameters for these modes were evaluated.

  11. Unusual fast secondary relaxation in metallic glass

    PubMed Central

    Wang, Q.; Zhang, S.T.; Yang, Y.; Dong, Y.D.; Liu, C.T.; Lu, J.

    2015-01-01

    The relaxation spectrum of glassy solids has long been used to probe their dynamic structural features and the fundamental deformation mechanisms. Structurally complicated glasses, such as molecular glasses, often exhibit multiple relaxation processes. By comparison, metallic glasses have a simple atomic structure with dense atomic packing, and their relaxation spectra were commonly found to be simpler than those of molecular glasses. Here we show the compelling evidence obtained across a wide range of temperatures and frequencies from a La-based metallic glass, which clearly shows two peaks of secondary relaxations (fast versus slow) in addition to the primary relaxation peak. The discovery of the unusual fast secondary relaxation unveils the complicated relaxation dynamics in metallic glasses and, more importantly, provides us the clues which help decode the structural features serving as the ‘trigger' of inelasticity on mechanical agitations. PMID:26204999

  12. Biaxial stress relaxation in glassy polymers - Polymethylmethacrylate.

    NASA Technical Reports Server (NTRS)

    Sternstein, S. S.; Ho, T. C.

    1972-01-01

    Biaxial stress relaxation studies were performed on glassy polymethylmethacrylate in combined torsion-tension strain fields using a specially designed apparatus with exceptionally high stiffness and low cross talk between the torsional and tensile load measuring transducers. It was found that at low strain levels uniaxial tension relaxation is slower than pure torsion relaxation; tensile-component relaxation rates are unaffected by the level of torsional strain; torsional-component relaxation rates decrease as tensile strain is increased; uniaxial tension relaxation rates approach the pure torsion rates at higher strains (about 2%). A phenomenological treatment is presented which shows that relaxation rates can be coupled to the strain fields in which they are observed and yet be consistent with the concepts of linear viscoelasticity and the Boltzmann superposition integral.

  13. H-1 Relaxation Times of Metabolites in Biological Samples Obtained with Nondestructive Ex-vivo Slow-MAS NMR

    SciTech Connect

    Hu, Jian Zhi; Wind, Robert A.; Rommereim, Donald N.

    2006-03-01

    Methods suitable for measuring 1H relaxation times such as T1, T2 and T1p, in small sized biological objects including live cells, excised organs and tissues, oil seeds etc., were developed in this work. This was achieved by combining inversion-recovery, spin-echo, or spin lock segment with the phase-adjusted spinning sideband (PASS) technique that was applied at slow sample spinning rate. Here, 2D-PASS was used to produce a high-resolution 1H spectrum free from the magnetic susceptibility broadening so that the relaxation parameters of individual metabolite can be determined. Because of the slow spinning employed, tissue and cell damage due to sample spinning is minimized. The methodologies were demonstrated by measuring 1H T1, T2 and T1p of metabolites in excised rat livers and sesame seeds at spinning rates of as low as 40 Hz.

  14. Microscale simulations of NMR relaxation in porous media

    NASA Astrophysics Data System (ADS)

    Mohnke, Oliver; Klitzsch, Norbert

    2010-05-01

    In petrophysical applications of nuclear magnetic resonance (NMR), the measured relaxation signals originate from the fluid filled pore space. Hence, in rocks or sediments the water content directly corresponds to the initial amplitude of the recorded NMR relaxation signals. The relaxation rate (longitudinal/transversal decay time T1, T2) is sensitive to pore sizes and physiochemical properties of rock-fluid interfaces (surface relaxivity), as well as the concentration of paramagnetic ions in the fluid phases (bulk relaxivity). In the subproject A2 of the TR32 we aim at improving the basic understanding of these processes at the pore scale and thereby advancing the interpretation of NMR data by reducing the application of restrictive approximated interpretation schemes, e.g. for deriving pore size distributions, connectivity or permeability. In this respect we numerically simulate NMR relaxation data at the micro sale to study the impact of physical and hydrological parameters such as internal field gradients or pore connectivities on NMR signals. Joint numerical simulations of the NMR relaxation behavior (Bloch equations) in the presence of internal gradients (Ampere's law) and fluid flow (Navier-Stokes) on a pore scale dimension have been implemented in a finite element (FE) model using Comsol Multiphysics. Processes governing the time and spatial behavior of the nuclear magnetization density in a porous medium are diffusion and surface interactions at the rock-fluid interface. Based on Fick's law of diffusive motion Brownstein and Tarr (1979) introduced differential equations that describe the relaxation behavior of the Spin magnetization in single isolated pores and derived analytical solutions for simple geometries, i.e. spherical, cylindrical and planar. However, by numerically solving these equations in a general way using a FE algorithm this approach can be applied to study and simulate coupled complex pore systems, e.g. derived from computer tomography (CT

  15. Microscale simulations of NMR relaxation in porous media

    NASA Astrophysics Data System (ADS)

    Mohnke, O.; Klitzsch, N.; Clauser, C.

    2009-12-01

    In petrophysical applications of nuclear magnetic resonance (NMR), the measured relaxation signals originate from the fluid filled pore space. Hence, in rocks or sediments the water content directly corresponds to the initial amplitude of the recorded NMR relaxation signals. The relaxation rate (longitudinal/transversal decay time T1, T2) is sensitive to pore sizes and physiochemical properties of rock-fluid interfaces (surface relaxivity), as well as the concentration of paramagnetic ions in the fluid phases (bulk relaxivity). We aim at improving the basic understanding of these processes at the pore scale and thereby advancing the interpretation of NMR data by reducing the application of restrictive approximated interpretation schemes, e.g. for deriving pore size distributions, connectivity or permeability. In this respect we numerically simulate NMR relaxation data at the micro sale to study the impact of physical and hydrological parameters such as internal field gradients or pore connectivities on NMR signals. Joint numerical simulations of the NMR relaxation behavior (Bloch equations) in the presence of internal gradients (Ampere’s law) and fluid flow (Navier-Stokes) on a pore scale dimension have been implemented in a finite element (FE) model using Comsol Multiphysics. Processes governing the time and spatial behavior of the nuclear magnetization density in a porous medium are diffusion and surface interactions at the rock-fluid interface. Based on Fick's law of diffusive motion Brownstein and Tarr (1979) introduced differential equations that describe the relaxation behavior of the Spin magnetization in single isolated pores and derived analytical solutions for simple geometries, i.e. spherical, cylindrical and planar. However, by numerically solving these equations in a general way using a FE algorithm this approach can be applied to study and simulate coupled complex pore systems, e.g. derived from computer tomography (CT). In this respect substantial

  16. Excited States of Nucleic Acids Probed by Proton Relaxation Dispersion NMR Spectroscopy.

    PubMed

    Juen, Michael Andreas; Wunderlich, Christoph Hermann; Nußbaumer, Felix; Tollinger, Martin; Kontaxis, Georg; Konrat, Robert; Hansen, D Flemming; Kreutz, Christoph

    2016-09-19

    In this work an improved stable isotope labeling protocol for nucleic acids is introduced. The novel building blocks eliminate/minimize homonuclear (13) C and (1) H scalar couplings thus allowing proton relaxation dispersion (RD) experiments to report accurately on the chemical exchange of nucleic acids. Using site-specific (2) H and (13) C labeling, spin topologies are introduced into DNA and RNA that make (1) H relaxation dispersion experiments applicable in a straightforward manner. The novel RNA/DNA building blocks were successfully incorporated into two nucleic acids. The A-site RNA was previously shown to undergo a two site exchange process in the micro- to millisecond time regime. Using proton relaxation dispersion experiments the exchange parameters determined earlier could be recapitulated, thus validating the proposed approach. We further investigated the dynamics of the cTAR DNA, a DNA transcript that is involved in the viral replication cycle of HIV-1. Again, an exchange process could be characterized and quantified. This shows the general applicablility of the novel labeling scheme for (1) H RD experiments of nucleic acids.

  17. Excited States of Nucleic Acids Probed by Proton Relaxation Dispersion NMR Spectroscopy.

    PubMed

    Juen, Michael Andreas; Wunderlich, Christoph Hermann; Nußbaumer, Felix; Tollinger, Martin; Kontaxis, Georg; Konrat, Robert; Hansen, D Flemming; Kreutz, Christoph

    2016-09-19

    In this work an improved stable isotope labeling protocol for nucleic acids is introduced. The novel building blocks eliminate/minimize homonuclear (13) C and (1) H scalar couplings thus allowing proton relaxation dispersion (RD) experiments to report accurately on the chemical exchange of nucleic acids. Using site-specific (2) H and (13) C labeling, spin topologies are introduced into DNA and RNA that make (1) H relaxation dispersion experiments applicable in a straightforward manner. The novel RNA/DNA building blocks were successfully incorporated into two nucleic acids. The A-site RNA was previously shown to undergo a two site exchange process in the micro- to millisecond time regime. Using proton relaxation dispersion experiments the exchange parameters determined earlier could be recapitulated, thus validating the proposed approach. We further investigated the dynamics of the cTAR DNA, a DNA transcript that is involved in the viral replication cycle of HIV-1. Again, an exchange process could be characterized and quantified. This shows the general applicablility of the novel labeling scheme for (1) H RD experiments of nucleic acids. PMID:27533469

  18. Revisiting spin-lattice relaxation time measurements for dilute spins in high-resolution solid-state NMR spectroscopy.

    PubMed

    Fu, Riqiang; Li, Jun; Cui, Jingyu; Peng, Xinhua

    2016-07-01

    Numerous nuclear magnetic resonance (NMR) measurements of spin-lattice relaxation times (T1S) for dilute spins such as (13)C have led to investigations of the motional dynamics of individual functional groups in solid materials. In this work, we revisit the Solomon equations and analyze how the heteronuclear cross relaxation between the dilute S (e.g. (13)C) and abundant I (e.g. (1)H) spins affects the measured T1S values in solid-state NMR in the absence of (1)H saturation during the recovery time. It is found theoretically that at the beginning of the S spin magnetization recovery, the existence of non-equilibrium I magnetization introduces the heteronuclear cross relaxation effect onto the recovery of the S spin magnetization and confirmed experimentally that such a heteronuclear cross relaxation effect results in the recovery overshoot phenomena for the dilute spins when T1S is on the same order of T1H, leading to inaccurate measurements of the T1S values. Even when T1S is ten times larger than T1H, the heteronuclear cross relaxation effect on the measured T1S values is still noticeable. Furthermore, this cross relaxation effect on recovery trajectory of the S spins can be manipulated and even suppressed by preparing the initial I and S magnetization, so as to obtain the accurate T1S values. A sample of natural abundance l-isoleucine powder has been used to demonstrate the T1S measurements and their corresponding measured T1C values under various experimental conditions. PMID:27187211

  19. Revisiting spin-lattice relaxation time measurements for dilute spins in high-resolution solid-state NMR spectroscopy.

    PubMed

    Fu, Riqiang; Li, Jun; Cui, Jingyu; Peng, Xinhua

    2016-07-01

    Numerous nuclear magnetic resonance (NMR) measurements of spin-lattice relaxation times (T1S) for dilute spins such as (13)C have led to investigations of the motional dynamics of individual functional groups in solid materials. In this work, we revisit the Solomon equations and analyze how the heteronuclear cross relaxation between the dilute S (e.g. (13)C) and abundant I (e.g. (1)H) spins affects the measured T1S values in solid-state NMR in the absence of (1)H saturation during the recovery time. It is found theoretically that at the beginning of the S spin magnetization recovery, the existence of non-equilibrium I magnetization introduces the heteronuclear cross relaxation effect onto the recovery of the S spin magnetization and confirmed experimentally that such a heteronuclear cross relaxation effect results in the recovery overshoot phenomena for the dilute spins when T1S is on the same order of T1H, leading to inaccurate measurements of the T1S values. Even when T1S is ten times larger than T1H, the heteronuclear cross relaxation effect on the measured T1S values is still noticeable. Furthermore, this cross relaxation effect on recovery trajectory of the S spins can be manipulated and even suppressed by preparing the initial I and S magnetization, so as to obtain the accurate T1S values. A sample of natural abundance l-isoleucine powder has been used to demonstrate the T1S measurements and their corresponding measured T1C values under various experimental conditions.

  20. Revisiting spin-lattice relaxation time measurements for dilute spins in high-resolution solid-state NMR spectroscopy

    NASA Astrophysics Data System (ADS)

    Fu, Riqiang; Li, Jun; Cui, Jingyu; Peng, Xinhua

    2016-07-01

    Numerous nuclear magnetic resonance (NMR) measurements of spin-lattice relaxation times (T1S) for dilute spins such as 13C have led to investigations of the motional dynamics of individual functional groups in solid materials. In this work, we revisit the Solomon equations and analyze how the heteronuclear cross relaxation between the dilute S (e.g. 13C) and abundant I (e.g. 1H) spins affects the measured T1S values in solid-state NMR in the absence of 1H saturation during the recovery time. It is found theoretically that at the beginning of the S spin magnetization recovery, the existence of non-equilibrium I magnetization introduces the heteronuclear cross relaxation effect onto the recovery of the S spin magnetization and confirmed experimentally that such a heteronuclear cross relaxation effect results in the recovery overshoot phenomena for the dilute spins when T1S is on the same order of T1H, leading to inaccurate measurements of the T1S values. Even when T1S is ten times larger than T1H, the heteronuclear cross relaxation effect on the measured T1S values is still noticeable. Furthermore, this cross relaxation effect on recovery trajectory of the S spins can be manipulated and even suppressed by preparing the initial I and S magnetization, so as to obtain the accurate T1S values. A sample of natural abundance L-isoleucine powder has been used to demonstrate the T1S measurements and their corresponding measured T1C values under various experimental conditions.

  1. Transverse-Type Short-Circuited Thermoelements

    NASA Astrophysics Data System (ADS)

    Anatychuk, L. I.; Kobylyansky, R. R.

    2012-06-01

    This work reports on the results of theoretical and experimental research of short-circuited thermoelements (SCTE). Computer simulation was used to obtain the electric potential, current, and temperature distributions in the bulk of thermoelements. Computer optimization of such a thermoelement design was carried out to achieve maximum transverse thermoelectromotive force (thermoEMF) and efficiency. Experimental studies of the short-circuited thermoelements were pursued. Bi-Te alloys were used as the thermoelectric material. It was established that, among the transverse-type thermoelements, double short-circuited thermoelements achieve the highest values of transverse thermoEMF and efficiency.

  2. Transverse Emittance Reduction with Tapered Foil

    SciTech Connect

    Jiao, Yi; Chao, Alex; Cai, Yunhai; /SLAC

    2011-12-09

    The idea of reducing transverse emittance with tapered energy-loss foil is proposed by J.M. Peterson in 1980s and recently by B. Carlsten. In this paper, we present the physical model of tapered energy-loss foil and analyze the emittance reduction using the concept of eigen emittance. The study shows that, to reduce transverse emittance, one should collimate at least 4% of particles which has either much low energy or large transverse divergence. The multiple coulomb scattering is not trivial, leading to a limited emittance reduction ratio. Small transverse emittances are of essential importance for the accelerator facilities generating free electron lasers, especially in hard X-ray region. The idea of reducing transverse emittance with tapered energy-loss foil is recently proposed by B. Carlsten [1], and can be traced back to J.M. Peterson's work in 1980s [2]. Peterson illustrated that a transverse energy gradient can be produced with a tapered energy-loss foil which in turn leads to transverse emittance reduction, and also analyzed the emittance growth from the associated multiple coulomb scattering. However, what Peterson proposed was rather a conceptual than a practical design. In this paper, we build a more complete physical model of the tapered foil based on Ref. [2], including the analysis of the transverse emittance reduction using the concept of eigen emittance and confirming the results by various numerical simulations. The eigen emittance equals to the projected emittance when there is no cross correlation in beam's second order moments matrix [3]. To calculate the eigen emittances, it requires only to know the beam distribution at the foil exit. Thus, the analysis of emittance reduction and the optics design of the subsequent beam line section can be separated. In addition, we can combine the effects of multiple coulomb scattering and transverse energy gradient together in the beam matrix and analyze their net effect. We find that,when applied to an

  3. Transverse Colon Diverticulitis with Calcified Fecalith

    PubMed Central

    Solak, Aynur; Solak, Ilhami; Genç, Berhan; Sahin, Neslin; Yalaz, Seyhan

    2013-01-01

    Left colonic diverticula are common in Western populations, whereas right colonic diverticulosis primarily occurs in Oriental populations. Diverticulitis of the transverse colon is very rare, with very few cases reported in the literature. Herein, we report a case of transverse colon diverticulitis caused by a calcified stone in a 69-year-old female. This was a solitary diverticulum. The signs and symptoms of the disease are similar to acute pancreatitis. To the best of our knowledge, this is the first report describing the MRI findings of a patient with trans-verse colon diverticulitis caused by a calcified stone. PMID:25610254

  4. Ferroelectric Cathodes in Transverse Magnetic Fields

    SciTech Connect

    Alexander Dunaevsky; Yevgeny Raitses; Nathaniel J. Fisch

    2002-07-29

    Experimental investigations of a planar ferroelectric cathode in a transverse magnetic field up to 3 kGs are presented. It is shown that the transverse magnetic field affects differently the operation of ferroelectric plasma cathodes in ''bright'' and ''dark'' modes in vacuum. In the ''bright'' mode, when the surface plasma is formed, the application of the transverse magnetic field leads to an increase of the surface plasma density. In the ''dark'' mode, the magnetic field inhibits the development of electron avalanches along the surface, as it does similarly in other kinds of surface discharges in the pre-breakdown mode.

  5. Arbutus unedo induces endothelium-dependent relaxation of the isolated rat aorta.

    PubMed

    Ziyyat, Abderrahim; Mekhfi, Hassane; Bnouham, Mohamed; Tahri, Abdelhafid; Legssyer, Abdelkhaleq; Hoerter, Jacqueline; Fischmeister, Rodolphe

    2002-09-01

    Arbutus unedo L. (Ericaceae) is used in oriental Morocco to treat arterial hypertension. We studied its vasodilator effect and mechanisms of action in vitro. The root aqueous extract of Arbutus (0.25 mg/mL) produced a relaxation of noradrenaline-precontracted ring preparations of rat aorta with intact endothelium. Relaxation by Arbutus did not occur in specimens without endothelium and was inhibited by pretreatment with 100 microM N(G)-methyl-L-arginine (L-NMA), 10 microM methylene blue or 50 microM 1H-[1,2,4] oxadiazolo [4,3-a] quinoxaline-1-one (ODQ) but not by 10 microM atropine. These results suggest that Arbutus produces an endothelium-dependent relaxation of the isolated rat aorta which may be mediated mainly by a stimulation of the endothelial nitric oxide synthase by mechanisms other than activation of muscarinic receptors. PMID:12237817

  6. Pressure-induced emergence of unusually high-frequency transverse excitations in a liquid alkali metal: Evidence of two types of collective excitations contributing to the transverse dynamics at high pressures

    SciTech Connect

    Bryk, Taras; Ruocco, G.; Scopigno, T.

    2015-09-14

    Unlike phonons in crystals, the collective excitations in liquids cannot be treated as propagation of harmonic displacements of atoms around stable local energy minima. The viscoelasticity of liquids, reflected in transition from the adiabatic to elastic high-frequency speed of sound and in absence of the long-wavelength transverse excitations, results in dispersions of longitudinal (L) and transverse (T) collective excitations essentially different from the typical phonon ones. Practically, nothing is known about the effect of high pressure on the dispersion of collective excitations in liquids, which causes strong changes in liquid structure. Here dispersions of L and T collective excitations in liquid Li in the range of pressures up to 186 GPa were studied by ab initio simulations. Two methodologies for dispersion calculations were used: direct estimation from the peak positions of the L/T current spectral functions and simulation-based calculations of wavenumber-dependent collective eigenmodes. It is found that at ambient pressure, the longitudinal and transverse dynamics are well separated, while at high pressures, the transverse current spectral functions, density of vibrational states, and dispersions of collective excitations yield evidence of two types of propagating modes that contribute strongly to transverse dynamics. Emergence of the unusually high-frequency transverse modes gives evidence of the breakdown of a regular viscoelastic theory of transverse dynamics, which is based on coupling of a single transverse propagating mode with shear relaxation. The explanation of the observed high-frequency shift above the viscoelastic value is given by the presence of another branch of collective excitations. With the pressure increasing, coupling between the two types of collective excitations is rationalized within a proposed extended viscoelastic model of transverse dynamics.

  7. Stereospecificity of (1) H, (13) C and (15) N shielding constants in the isomers of methylglyoxal bisdimethylhydrazone: problem with configurational assignment based on (1) H chemical shifts.

    PubMed

    Afonin, Andrei V; Pavlov, Dmitry V; Ushakov, Igor A; Keiko, Natalia A

    2012-07-01

    In the (13) C NMR spectra of methylglyoxal bisdimethylhydrazone, the (13) C-5 signal is shifted to higher frequencies, while the (13) C-6 signal is shifted to lower frequencies on going from the EE to ZE isomer following the trend found previously. Surprisingly, the (1) H-6 chemical shift and (1) J(C-6,H-6) coupling constant are noticeably larger in the ZE isomer than in the EE isomer, although the configuration around the -CH═N- bond does not change. This paradox can be rationalized by the C-H⋯N intramolecular hydrogen bond in the ZE isomer, which is found from the quantum-chemical calculations including Bader's quantum theory of atoms in molecules analysis. This hydrogen bond results in the increase of δ((1) H-6) and (1) J(C-6,H-6) parameters. The effect of the C-H⋯N hydrogen bond on the (1) H shielding and one-bond (13) C-(1) H coupling complicates the configurational assignment of the considered compound because of these spectral parameters. The (1) H, (13) C and (15) N chemical shifts of the 2- and 8-(CH(3) )(2) N groups attached to the -C(CH(3) )═N- and -CH═N- moieties, respectively, reveal pronounced difference. The ab initio calculations show that the 8-(CH(3) )(2) N group conjugate effectively with the π-framework, and the 2-(CH(3) )(2) N group twisted out from the plane of the backbone and loses conjugation. As a result, the degree of charge transfer from the N-2- and N-8- nitrogen lone pairs to the π-framework varies, which affects the (1) H, (13) C and (15) N shieldings. PMID:22615146

  8. A classical approach in simple nuclear fusion reaction {sub 1}H{sup 2}+{sub 1}H{sup 3} using two-dimension granular molecular dynamics model

    SciTech Connect

    Viridi, S.; Kurniadi, R.; Waris, A.; Perkasa, Y. S.

    2012-06-06

    Molecular dynamics in 2-D accompanied by granular model provides an opportunity to investigate binding between nuclei particles and its properties that arises during collision in a fusion reaction. A fully classical approach is used to observe the influence of initial angle of nucleus orientation to the product yielded by the reaction. As an example, a simplest fusion reaction between {sub 1}H{sup 2} and {sub 1}H{sup 3} is observed. Several products of the fusion reaction have been obtained, even the unreported ones, including temporary {sub 2}He{sup 4} nucleus.

  9. Molecular structure studies of (1S,2S)-2-benzyl-2,3-dihydro-2-(1H-inden-2-yl)-1H-inden-1-ol

    PubMed Central

    Zhang, Tao; Paluch, Krzysztof; Scalabrino, Gaia; Frankish, Neil; Healy, Anne-Marie; Sheridan, Helen

    2015-01-01

    The single enantiomer (1S,2S)-2-benzyl-2,3-dihydro-2-(1H-inden-2-yl)-1H-inden-1-ol (2), has recently been synthesized and isolated from its corresponding diastereoisomer (1). The molecular and crystal structures of this novel compound have been fully analyzed. The relative and absolute configurations have been determined by using a combination of analytical tools including X-ray crystallography, X-ray Powder Diffraction (XRPD) analysis and Nuclear Magnetic Resonance (NMR) spectroscopy. PMID:25750458

  10. Spin-spin coupling in the HD molecule determined from 1H and 2H NMR experiments in the gas-phase

    NASA Astrophysics Data System (ADS)

    Garbacz, Piotr

    2014-10-01

    The indirect spin-spin coupling of hydrogen deuteride, J(D, H), was determined from a series of 1H and 2H NMR spectra acquired at various densities of gaseous solvents (He, Ar, CO2, and N2O). The analysis of these spectra shows that accurate determination of J(D, H) from this experimental data requires careful examination of the effects of nuclear relaxation and of HD-solvent gas interactions on hydrogen deuteride line shapes. Particularly, it was found that the first-order corrections of the peak-to-peak separations between HD multiplet peaks due to weak van der Waals interactions are proportional to solvent gas density, while these corrections for nuclear relaxation of the proton and the deuteron are proportional to the second power of the inverse of the gas density. Analysis of the data indicates that J(D, H), obtained by correcting for the effects of nuclear relaxation and intermolecular interactions, is 43.136(7) Hz at 300 K.

  11. In-situ analysis and quantification of swelling kinetics in glassy and rubbery networks using [sup 1]H and [sup 19]F magnetic resonance microscopies

    SciTech Connect

    Cody, G.D.; Botto, R.E. . Chemistry Div.)

    1994-04-25

    [sup 1]H and [sup 19]F magnetic resonance microscopies are used to determine the characteristics of diffusion in four different network-solvent systems. Transport of methanol in poly(ethyl methacrylate) (PEMA) and pyridine in coal is explored and compared with Fickian transport of toluene in polybutadiene rubber (PBD) and hexafluorobenzene in poly(methyl silicone) (PMS). These former two systems are characterized by sharp solvent fronts which propagate into the cores of the samples at a constant velocity. The swelling kinetics are quantified by applying a simple model which couples the kinetics of solvent diffusion to a second-order phase transition which induces network relaxation. Parameterization is accomplished with two kinetic terms and one thermodynamic parameter. These are a mass-fixed glassy diffusion coefficient, a network relaxation constant, and a critical concentration corresponding to the concentration of solvent necessary to induce a glass to rubber transition. Solvent from velocities, obtained through magnetic resonance microscopy, are used with independently derived critical concentrations to calculate the glassy diffusion coefficient and network relaxation rate constant. Kinetic swelling data are then fit with theoretical uptake curves computed using these parameters. A high-quality fit demonstrates that the proposed model successfully quantifies non-Fickian transport using a small number of physical based dynamic parameters.

  12. Development of Transverse Modes Damped DLA Structure

    SciTech Connect

    Jing, C.; Kanareykin, A.; Schoessow, P.; Gai, W.; Konecny, R.; Power, J. G.; Conde, M.

    2009-01-22

    As the dimensions of accelerating structures become smaller and beam intensities higher, the transverse wakefields driven by the beam become quite large with even a slight misalignment of the beam from the geometric axis. These deflection modes can cause inter-bunch beam breakup and intra-bunch head-tail instabilities along the beam path, and thus BBU control becomes a critical issue. All new metal based accelerating structures, like the accelerating structures developed at SLAC or power extractors at CLIC, have designs in which the transverse modes are heavily damped. Similarly, minimizing the transverse wakefield modes (here the HEMmn hybrid modes in Dielectric-Loaded Accelerating (DLA) structures) is also very critical for developing dielectric based high energy accelerators. In this paper, we present the design of a 7.8 GHz transverse mode damped DLA structure currently under construction, along with plans for the experimental program.

  13. Transverse damping systems in modern synchrotrons

    NASA Astrophysics Data System (ADS)

    Zhabitsky, V. M.

    2006-12-01

    Transverse feedback systems for suppression of transverse coherent beam oscillations are used in modern synchrotrons for preventing the development of transverse instabilities and damping residual beam oscillations after injection. Information on damper systems for the Large Hadron Collider (LHC; CERN, Geneva) and the accelerator complex FAIR (GSI, Darmstadt) is presented. The project for the LHC is being performed at the Laboratory of Particle Physics of the Joint Institute for Nuclear Research in collaboration with CERN. The information concerning the state of the project and the plans of its completion at the LHC is given. The results of the first design activity on transverse damping systems at the SIS100 and SIS300 synchrotrons, to be created in the framework of the new international project FAIR, are presented.

  14. Transversally periodic solitary gravity-capillary waves.

    PubMed

    Milewski, Paul A; Wang, Zhan

    2014-01-01

    When both gravity and surface tension effects are present, surface solitary water waves are known to exist in both two- and three-dimensional infinitely deep fluids. We describe here solutions bridging these two cases: travelling waves which are localized in the propagation direction and periodic in the transverse direction. These transversally periodic gravity-capillary solitary waves are found to be of either elevation or depression type, tend to plane waves below a critical transverse period and tend to solitary lumps as the transverse period tends to infinity. The waves are found numerically in a Hamiltonian system for water waves simplified by a cubic truncation of the Dirichlet-to-Neumann operator. This approximation has been proved to be very accurate for both two- and three-dimensional computations of fully localized gravity-capillary solitary waves. The stability properties of these waves are then investigated via the time evolution of perturbed wave profiles. PMID:24399922

  15. Transversally periodic solitary gravity-capillary waves.

    PubMed

    Milewski, Paul A; Wang, Zhan

    2014-01-01

    When both gravity and surface tension effects are present, surface solitary water waves are known to exist in both two- and three-dimensional infinitely deep fluids. We describe here solutions bridging these two cases: travelling waves which are localized in the propagation direction and periodic in the transverse direction. These transversally periodic gravity-capillary solitary waves are found to be of either elevation or depression type, tend to plane waves below a critical transverse period and tend to solitary lumps as the transverse period tends to infinity. The waves are found numerically in a Hamiltonian system for water waves simplified by a cubic truncation of the Dirichlet-to-Neumann operator. This approximation has been proved to be very accurate for both two- and three-dimensional computations of fully localized gravity-capillary solitary waves. The stability properties of these waves are then investigated via the time evolution of perturbed wave profiles.

  16. Chronic Osteomyelitis of the Lumbar Transverse Process

    PubMed Central

    Lee, Bong-Jin; Yoon, Min Geun; Kim, Sung-Soo; Moon, Myung-Sang

    2011-01-01

    Pyogenic spondylitis involving only the posterior element of a vertebra is rare. To the best of our knowledge, there have been no reports of osteomyelitis of the transverse process. We report here on a 45-year-old male with a one month history of swelling associated with lower back pain. The magnetic resonance imaging showed a paraspinal soft tissue mass, and computed tomography revealed a fine osteolytic lesion in the right transverse process of the 5th lumbar spine, and this was all consistent with chronic osteomyelitis. A mixed staphylococcal infection was identified. Open drainage, resection of the transverse process and intravenous injection of anti-staphylococcal antibiotics resolved the back pain and reduced the erythrocyte sedimentation rate to normal. Pyogenic osteomyelitis of the transverse process is extremely rare, which can cause a misdiagnosis or a delayed diagnosis. Careful consideration of this disease is needed when evaluating patients who complain of back pain. PMID:21909475

  17. Exploring the transverse spin structure of the nucleon

    SciTech Connect

    D'Alesio, Umberto

    2008-10-13

    We discuss our present understanding of the transverse spin structure of the nucleon and of related properties originating from parton transverse motion. Starting from the transversity distribution and the ways to access it, we then address the role played by spin and transverse momentum dependent (TMD) distributions in azimuthal and transverse single spin asymmetries. The latest extractions of the Sivers, Collins and transversity functions are also presented.

  18. 1H magnetic resonance spectroscopy of invasive cervical cancer: an in vivo study with ex vivo corroboration.

    PubMed

    Mahon, Marrita M; Williams, Andreanna D; Soutter, W Patrick; Cox, I Jane; McIndoe, G Angus; Coutts, Glyn A; Dina, Roberto; deSouza, Nandita M

    2004-02-01

    The objective of this study was to establish in vivo (1)H-magnetic resonance (MR) spectroscopic appearances of cervical cancer using an endovaginal receiver coil and corroborate findings with magic angle spinning (MAS) MR spectroscopy of tissue samples. Fifty-three women (14 controls and 39 with cervical cancer) underwent endovaginal coil MR imaging at 1.5 T with T(1)- and T(2)-weighted scans sagittal and transverse to the cervix. Localized (1)H MR spectra (PRESS technique, TR 1600 ms, TE 135 ms) were accumulated in all controls and 29 cancer patients whose tumour filled > 50% of a single 3.4 cm(3) voxel. Peaks from triglyceride-CH(2) and -CH(3) were defined as present and in-phase (with the choline resonance), present but out-of-phase, or not present. Peak areas of choline-containing compounds were standardized to the area of unsuppressed tissue water resonance. Comparisons in observed resonances between groups were made using Fisher's exact test (qualitative data) and a t-test (quantitative data). Biopsies from these women analysed using MAS-MR spectroscopy and normalized to the intensity of an external standard of silicone rubber were similarly compared. Adequate water suppression permitted spectral analysis in 11 controls and 27 cancer patients. In-phase triglyceride-CH(2) resonances (1.3 ppm) were observed in 74% of tumours but in no control women (p < 0.001). No differences were observed in the presence of a 2 ppm resonance, choline-containing compounds or creatine in cancer compared with control women. However, ex vivo analysis showed significant differences not only in -CH(2), but also in -CH(3), a 2 ppm resonance, choline-containing compounds and creatine between tissues from control women and cancer tissue (p < 0.001, = 0.001, = 0.036, < 0.001 and = 0.004 respectively). On in vivo (1)H-MR spectroscopy, the presence of positive triglyceride-CH(2) resonances can be used to detect and confirm the presence of cervical cancer. However, technical improvements

  19. Chiral dynamics and peripheral transverse densities

    SciTech Connect

    Granados, Carlos G.; Weiss, Christian

    2014-01-01

    In the partonic (or light-front) description of relativistic systems the electromagnetic form factors are expressed in terms of frame-independent charge and magnetization densities in transverse space. This formulation allows one to identify the chiral components of nucleon structure as the peripheral densities at transverse distances b = O(M{sub {pi}}{sup -1}) and compute them in a parametrically controlled manner. A dispersion relation connects the large-distance behavior of the transverse charge and magnetization densities to the spectral functions of the Dirac and Pauli form factors near the two--pion threshold at timelike t = 4 M{ sub {pi}}{sup 2}, which can be computed in relativistic chiral effective field theory. Using the leading-order approximation we (a) derive the asymptotic behavior (Yukawa tail) of the isovector transverse densities in the "chiral" region b = O(M{sub {pi}}{sup -1}) and the "molecular" region b = O(M{sub N}{sup 2}/M{sub {pi}}{sup 3}); (b) perform the heavy-baryon expansion of the transverse densities; (c) explain the relative magnitude of the peripheral charge and magnetization densities in a simple mechanical picture; (d) include Delta isobar intermediate states and study the peripheral transverse densities in the large-N{ sub c} limit of QCD; (e) quantify the region of transverse distances where the chiral components of the densities are numerically dominant; (f) calculate the chiral divergences of the b{sup 2}-weighted moments of the isovector transverse densities (charge and anomalous magnetic radii) in the limit M{sub {pi}} -> 0 and determine their spatial support. Our approach provides a concise formulation of the spatial structure of the nucleon's chiral component and offers new insights into basic properties of the chiral expansion. It relates the information extracted from low-t elastic form factors to the generalized parton distributions probed in peripheral high-energy scattering processes.

  20. Relaxation damping in oscillating contacts.

    PubMed

    Popov, M; Popov, V L; Pohrt, R

    2015-01-01

    If a contact of two purely elastic bodies with no sliding (infinite coefficient of friction) is subjected to superimposed oscillations in the normal and tangential directions, then a specific damping appears, that is not dependent on friction or dissipation in the material. We call this effect "relaxation damping". The rate of energy dissipation due to relaxation damping is calculated in a closed analytic form for arbitrary axially-symmetric contacts. In the case of equal frequency of normal and tangential oscillations, the dissipated energy per cycle is proportional to the square of the amplitude of tangential oscillation and to the absolute value of the amplitude of normal oscillation, and is dependent on the phase shift between both oscillations. In the case of low frequency tangential oscillations with superimposed high frequency normal oscillations, the dissipation is proportional to the ratio of the frequencies. Generalization of the results for macroscopically planar, randomly rough surfaces as well as for the case of finite friction is discussed. PMID:26549011

  1. Violent relaxation of ellipsoidal clouds

    NASA Astrophysics Data System (ADS)

    Benhaiem, David; Sylos Labini, Francesco

    2015-04-01

    An isolated, initially cold and ellipsoidal cloud of self-gravitating particles represents a relatively simple system in which to study the effects of deviations from spherical symmetry in the mechanism of violent relaxation. Initial deviations from spherical symmetry are shown to play a dynamical role that is equivalent to that of density fluctuations in the case of an initially spherical cloud. Indeed, these deviations control the amount of particle-energy change and thus determine the properties of the final energy distribution, particularly the appearance of two species of particles: bound and free. Ejection of mass and energy from the system, together with the formation of a density profile decaying as ρ(r) ˜ r-4 and a Keplerian radial velocity dispersion profile, are prominent features similar to those observed after the violent relaxation of spherical clouds. In addition, we find that ejected particles are characterized by highly non-spherical shapes, the features of which can be traced in the initial deviations from spherical symmetry that are amplified during the dynamical evolution: particles can indeed form anisotropic configurations, like bars and/or discs, even though the initial cloud was very close to spherical.

  2. Relaxation damping in oscillating contacts

    PubMed Central

    Popov, M.; Popov, V.L.; Pohrt, R.

    2015-01-01

    If a contact of two purely elastic bodies with no sliding (infinite coefficient of friction) is subjected to superimposed oscillations in the normal and tangential directions, then a specific damping appears, that is not dependent on friction or dissipation in the material. We call this effect “relaxation damping”. The rate of energy dissipation due to relaxation damping is calculated in a closed analytic form for arbitrary axially-symmetric contacts. In the case of equal frequency of normal and tangential oscillations, the dissipated energy per cycle is proportional to the square of the amplitude of tangential oscillation and to the absolute value of the amplitude of normal oscillation, and is dependent on the phase shift between both oscillations. In the case of low frequency tangential oscillations with superimposed high frequency normal oscillations, the dissipation is proportional to the ratio of the frequencies. Generalization of the results for macroscopically planar, randomly rough surfaces as well as for the case of finite friction is discussed. PMID:26549011

  3. Transverse pelvic rotation during quiet human stance.

    PubMed

    Günther, Michael; Otto, Daniel; Müller, Otto; Blickhan, Reinhard

    2008-04-01

    The mechanism of two-legged quiet stance is unclear. This study specifically investigated biomechanical parameters characterising the mechanisms of rotation around the longitudinal axis (parallel to gravitational acceleration, i.e. in the transverse plane parallel to the ground). Subjects (10) were examined while standing quietly on two force platforms which measured the transverse component of the ground reaction torque (GRT). In addition, right and left hip kinematics were acquired by tracking markers in the sagittal plane. The pelvic rotation in the transverse plane (pelvic angle) was then calculated from the anterior-posterior coordinates of the hip markers. We verified the hypothesis that the pelvis generally may be coupled to the ground by a rotational stiffness provided by both legs. Thus, we asked whether the transverse GRT component may be proportional to the pelvic angle. This hypothesis was rejected. However, the transverse GRT component could be identified as one rotational stabilising mechanism which drove the higher-frequency (>1 Hz) deflections of the pelvic angle back to its lower-frequency fraction. The respective stiffness coefficient between transverse GRT component and relative displacement between higher- and lower-frequency pelvic angular fraction was about 2.4 Nm/degrees. Implications for the character and the localisation of active control of body rotation around the longitudinal axis are discussed.

  4. Transverse structure of the QCD string

    SciTech Connect

    Meyer, Harvey B.

    2010-11-15

    The characterization of the transverse structure of the QCD string is discussed. We formulate a conjecture as to how the stress-energy tensor of the underlying gauge theory couples to the string degrees of freedom. A consequence of the conjecture is that the energy density and the longitudinal-stress operators measure the distribution of the transverse position of the string, to leading order in the string fluctuations, whereas the transverse-stress operator does not. We interpret recent numerical measurements of the transverse size of the confining string and show that the difference of the energy and longitudinal-stress operators is a particularly natural probe at next-to-leading order. Second, we derive the constraints imposed by open-closed string duality on the transverse structure of the string. We show that a total of three independent ''gravitational'' form factors characterize the transverse profile of the closed string, and obtain the interpretation of recent effective string theory calculations: the square radius of a closed string of length {beta} defined from the slope of its gravitational form factor, is given by (d-1/2{pi}{sigma})log({beta}/4r{sub 0}) in d space dimensions. This is to be compared with the well-known result that the width of the open string at midpoint grows as (d-1/2{pi}{sigma})log(r/r{sub 0}). We also obtain predictions for transition form factors among closed-string states.

  5. Deuterium off-resonance rotating frame spin-lattice relaxation of macromolecular bound ligands.

    PubMed Central

    Rydzewski, J M; Schleich, T

    1996-01-01

    Deuterated 3-trimethylsilylpropionic acid binding to bovine serum albumin was used as a model system to examine the feasibility and limitations of using the deuterium off-resonance rotating frame spin-lattice relaxation experiment for the study of equilibrium ligand-binding behavior to proteins. The results of this study demonstrate that the rotational-diffusion behavior of the bound species can be monitored directly, i.e., the observed correlation time of the ligand in the presence of a protein is approximately equal to the correlation time of the ligand in the bound state, provided that the fraction of bound ligand is at least 0.20. The presence of local ligand motion and/or chemical exchange contributions to relaxation in the bound state was inferred from the observation that the correlation time of the bound ligand was somewhat smaller than the correlation time characterizing the overall tumbling of the protein. An approximate value for the fraction of bound ligand was obtained from off-resonance relaxation experiments when supplemental spin-lattice or transverse relaxation times were employed in the analysis. Incorporation of local motion effects for the bound species into the theoretical relaxation formalism enabled the evaluation of an order parameter and an effective correlation time, which in conjunction with a wobbling in a cone model, provided additional information about ligand motion in the bound state. PMID:8785304

  6. Sensitivity enhancement and low-field spin relaxation in singlet NMR.

    PubMed

    Bocan, Jiri; Pileio, Giuseppe; Levitt, Malcolm H

    2012-12-14

    The singlet states of nuclear spin-1/2 pairs often display extended lifetimes that can be an order of magnitude longer than conventional relaxation times. We show that, in favourable circumstances, acquisition of the NMR signal during an extended multiple spin-echo train, followed by suitable data processing, enhances the signal-to-noise ratio of singlet NMR by up to an order of magnitude. The achievable enhancement depends on the transverse relaxation time constant, the magnetic field inhomogeneity, and the acceptable degradation in digital spectral resolution. We use the combination of singlet NMR and multiple spin-echo data acquisition to study the low-field nuclear relaxation processes of (15)N-labelled nitrous oxide ((15)N(2)O) in solution. A general relaxation theory for coupled 2-spin-1/2 systems in low magnetic field is developed. Experimental trajectories of the nuclear spin observables are compared with theoretical expressions, including dipole-dipole and spin-rotation relaxation mechanisms. The estimated values of the spin-rotation tensors are compared with previous estimations from NMR and molecular beam electric resonance.

  7. Spin relaxation of a short-lived radical in zero magnetic field.

    PubMed

    McKenzie, Iain

    2011-01-21

    A short-lived radical containing only one I = 1/2 nucleus, the muoniated 1,2-dicarboxyvinyl radical dianion, was produced in an aqueous solution by the reaction of muonium with the dicarboxyacetylene dianion. The identity of the radical was confirmed by measuring the muon hyperfine coupling constant (hfcc) by transverse field muon spin rotation spectroscopy and comparing this value with the hfcc obtained from DFT calculations. The muon spin relaxation rate of this radical was measured as a function of temperature in zero magnetic field by the zero field muon spin relaxation technique. The results have been interpreted using the theoretical model of Fedin et al. (J. Chem. Phys., 2003, 118, 192). The muon spin polarization decreases exponentially with time after muon implantation and the temperature dependence of the spin relaxation rate indicates that the dominant relaxation mechanism is the modulation of the anisotropic hyperfine interaction due to molecular rotation. The effective radius of the radical in solution was determined to be 1.12 ± 0.04 nm from the dependence of the muon spin relaxation rate on the temperature and viscosity of the solution, and is approximately 3.6 times larger than the value obtained from DFT calculations.

  8. Genetic deletion of aquaporin-1 results in microcardia and low blood pressure in mouse with intact nitric oxide-dependent relaxation, but enhanced prostanoids-dependent relaxation.

    PubMed

    Montiel, V; Leon Gomez, E; Bouzin, C; Esfahani, H; Romero Perez, M; Lobysheva, I; Devuyst, O; Dessy, C; Balligand, J L

    2014-02-01

    The water channels, aquaporins (AQPs) are key mediators of transcellular fluid transport. However, their expression and role in cardiac tissue is poorly characterized. Particularly, AQP1 was suggested to transport other molecules (nitric oxide (NO), hydrogen peroxide (H2O2)) with potential major bearing on cardiovascular physiology. We therefore examined the expression of all AQPs and the phenotype of AQP1 knockout mice (vs. wild-type littermates) under implanted telemetry in vivo, as well as endothelium-dependent relaxation in isolated aortas and resistance vessels ex vivo. Four aquaporins were expressed in wild-type heart tissue (AQP1, AQP7, AQP4, AQP8) and two aquaporins in aortic and mesenteric vessels (AQP1-AQP7). AQP1 was expressed in endothelial as well as cardiac and vascular muscle cells and co-segregated with caveolin-1. AQP1 knockout (KO) mice exhibited a prominent microcardia and decreased myocyte transverse dimensions despite no change in capillary density. Both male and female AQP1 KO mice had lower mean BP, which was not attributable to altered water balance or autonomic dysfunction (from baroreflex and frequency analysis of BP and HR variability). NO-dependent BP variability was unperturbed. Accordingly, endothelium-derived hyperpolarizing factor (EDH(F)) or NO-dependent relaxation were unchanged in aorta or resistance vessels ex vivo. However, AQP1 KO mesenteric vessels exhibited an increase in endothelial prostanoids-dependent relaxation, together with increased expression of COX-2. This enhanced relaxation was abrogated by COX inhibition. We conclude that AQP1 does not regulate the endothelial EDH or NO-dependent relaxation ex vivo or in vivo, but its deletion decreases baseline BP together with increased prostanoids-dependent relaxation in resistance vessels. Strikingly, this was associated with microcardia, unrelated to perturbed angiogenesis. This may raise interest for new inhibitors of AQP1 and their use to treat hypertrophic cardiac

  9. 2D 1H and 3D 1H-15N NMR of zinc-rubredoxins: contributions of the beta-sheet to thermostability.

    PubMed Central

    Richie, K. A.; Teng, Q.; Elkin, C. J.; Kurtz, D. M.

    1996-01-01

    Based on 2D 1H-1H and 2D and 3D 1H-15N NMR spectroscopies, complete 1H NMR assignments are reported for zinc-containing Clostridium pasteurianum rubredoxin (Cp ZnRd). Complete 1H NMR assignments are also reported for a mutated Cp ZnRd, in which residues near the N-terminus, namely, Met 1, Lys 2, and Pro 15, have been changed to their counterparts, (-), Ala and Glu, respectively, in rubredoxin from the hyperthermophilic archaeon, Pyrococcus furiosus (Pf Rd). The secondary structure of both wild-type and mutated Cp ZnRds, as determined by NMR methods, is essentially the same. However, the NMR data indicate an extension of the three-stranded beta-sheet in the mutated Cp ZnRd to include the N-terminal Ala residue and Glu 15, as occurs in Pf Rd. The mutated Cp Rd also shows more intense NOE cross peaks, indicating stronger interactions between the strands of the beta-sheet and, in fact, throughout the mutated Rd. However, these stronger interactions do not lead to any significant increase in thermostability, and both the mutated and wild-type Cp Rds are much less thermostable than Pf Rd. These correlations strongly suggest that, contrary to a previous proposal [Blake PR et al., 1992, Protein Sci 1:1508-1521], the thermostabilization mechanism of Pf Rd is not dominated by a unique set of hydrogen bonds or electrostatic interactions involving the N-terminal strand of the beta-sheet. The NMR results also suggest that an overall tighter protein structure does not necessarily lead to increased thermostability. PMID:8732760

  10. Analysis of reliable sub-ns spin-torque switching under transverse bias magnetic fields

    SciTech Connect

    D'Aquino, M.; Perna, S.; Serpico, C.; Bertotti, G.; Mayergoyz, I. D.

    2015-05-07

    The switching process of a magnetic spin-valve nanosystem subject to spin-polarized current pulses is considered. The dependence of the switching probability on the current pulse duration is investigated. The further application of a transverse field along the intermediate anisotropy axis of the particle is used to control the quasi-random relaxation of magnetization to the reversed magnetization state. The critical current amplitudes to realize the switching are determined by studying the phase portrait of the Landau-Lifshtz-Slonczewski dynamics. Macrospin numerical simulations are in good agreement with the theoretical prediction and demonstrate reliable switching even for very short (below 100 ps) current pulses.

  11. A numerical study of vector resonant relaxation

    NASA Astrophysics Data System (ADS)

    Kocsis, Bence; Tremaine, Scott

    2015-04-01

    Stars bound to a supermassive black hole interact gravitationally. Persistent torques acting between stellar orbits lead to a rapid resonant relaxation of the orbital orientation vectors (`vector' resonant relaxation) and slower relaxation of the eccentricities (`scalar' resonant relaxation), both at rates much faster than two-body or non-resonant relaxation. We describe a new parallel symplectic integrator, N-RING, which follows the dynamical evolution of a cluster of N stars through vector resonant relaxation, by averaging the pairwise interactions over the orbital period and periapsis precession time-scale. We use N-RING to follow the evolution of clusters containing over 104 stars for tens of relaxation times. Among other results, we find that the evolution is dominated by torques among stars with radially overlapping orbits, and that resonant relaxation can be modelled as a random walk of the orbit normals on the sphere, with angular step size ranging from ˜0.5-1 rad. The relaxation rate in a cluster with a fixed number of stars is proportional to the root mean square (rms) mass of the stars. The rms torque generated by the cluster stars is reduced below the torque between Kepler orbits due to apsidal precession and declines weakly with the eccentricity of the perturbed orbit. However, since the angular momentum of an orbit also decreases with eccentricity, the relaxation rate is approximately eccentricity-independent for e ≲ 0.7 and grows rapidly with eccentricity for e ≳ 0.8. We quantify the relaxation using the autocorrelation function of the spherical multipole moments; this decays exponentially and the e-folding time may be identified with the vector resonant relaxation time-scale.

  12. Dielectric relaxation in a protein matrix

    SciTech Connect

    Pierce, D.W.; Boxer, S.G.

    1992-06-25

    The dielectric relaxation of a sperm whale ApoMb-DANCA complex is measured by the fluorescence dynamic Stokes shift method. Emission energy increases with decreasing temperature, suggesting that the relaxation activation energies of the rate-limiting motions either depend on the conformational substrate or different types of protein motions with different frequencies participate in the reaction. Experimental data suggest that there may be relaxations on a scale of <100 ps. 61 refs., 7 figs., 2 tabs.

  13. Nuclear magnetic relaxation by the dipolar EMOR mechanism: General theory with applications to two-spin systems.

    PubMed

    Chang, Zhiwei; Halle, Bertil

    2016-02-28

    In aqueous systems with immobilized macromolecules, including biological tissue, the longitudinal spin relaxation of water protons is primarily induced by exchange-mediated orientational randomization (EMOR) of intra- and intermolecular magnetic dipole-dipole couplings. We have embarked on a systematic program to develop, from the stochastic Liouville equation, a general and rigorous theory that can describe relaxation by the dipolar EMOR mechanism over the full range of exchange rates, dipole coupling strengths, and Larmor frequencies. Here, we present a general theoretical framework applicable to spin systems of arbitrary size with symmetric or asymmetric exchange. So far, the dipolar EMOR theory is only available for a two-spin system with symmetric exchange. Asymmetric exchange, when the spin system is fragmented by the exchange, introduces new and unexpected phenomena. Notably, the anisotropic dipole couplings of non-exchanging spins break the axial symmetry in spin Liouville space, thereby opening up new relaxation channels in the locally anisotropic sites, including longitudinal-transverse cross relaxation. Such cross-mode relaxation operates only at low fields; at higher fields it becomes nonsecular, leading to an unusual inverted relaxation dispersion that splits the extreme-narrowing regime into two sub-regimes. The general dipolar EMOR theory is illustrated here by a detailed analysis of the asymmetric two-spin case, for which we present relaxation dispersion profiles over a wide range of conditions as well as analytical results for integral relaxation rates and time-dependent spin modes in the zero-field and motional-narrowing regimes. The general theoretical framework presented here will enable a quantitative analysis of frequency-dependent water-proton longitudinal relaxation in model systems with immobilized macromolecules and, ultimately, will provide a rigorous link between relaxation-based magnetic resonance image contrast and molecular parameters

  14. A common polymorphism in NR1H2 (LXRbeta) is associated with preeclampsia

    PubMed Central

    2011-01-01

    Background Preeclampsia is a frequent complication of pregnancy and a leading cause of perinatal mortality. Both genetic and environmental risk factors have been identified. Lipid metabolism, particularly cholesterol metabolism, is associated with this disease. Liver X receptors alpha (NR1H3, also known as LXRalpha) and beta (NR1H2, also known as LXRbeta) play a key role in lipid metabolism. They belong to the nuclear receptor superfamily and are activated by cholesterol derivatives. They have been implicated in preeclampsia because they modulate trophoblast invasion and regulate the expression of the endoglin (CD105) gene, a marker of preeclampsia. The aim of this study was to investigate associations between the NR1H3 and NR1H2 genes and preeclampsia. Methods We assessed associations between single nucleotide polymorphisms of NR1H3 (rs2279238 and rs7120118) and NR1H2 (rs35463555 and rs2695121) and the disease in 155 individuals with preeclampsia and 305 controls. Genotypes were determined by high-resolution melting analysis. We then used a logistic regression model to analyze the different alleles and genotypes for those polymorphisms as a function of case/control status. Results We found no association between NR1H3 SNPs and the disease, but the NR1H2 polymorphism rs2695121 was found to be strongly associated with preeclampsia (genotype C/C: adjusted odds ratio, 2.05; 95% CI, 1.04-4.05; p = 0.039 and genotype T/C: adjusted odds ratio, 1.85; 95% CI, 1.01-3.42; p = 0.049). Conclusions This study provides the first evidence of an association between the NR1H2 gene and preeclampsia, adding to our understanding of the links between cholesterol metabolism and this disease. PMID:22029530

  15. Temperature relaxation in dense plasma mixtures

    NASA Astrophysics Data System (ADS)

    Faussurier, Gérald; Blancard, Christophe

    2016-09-01

    We present a model to calculate temperature-relaxation rates in dense plasma mixtures. The electron-ion relaxation rates are calculated using an average-atom model and the ion-ion relaxation rates by the Landau-Spitzer approach. This method allows the study of the temperature relaxation in many-temperature electron-ion and ion-ion systems such as those encountered in inertial confinement fusion simulations. It is of interest for general nonequilibrium thermodynamics dealing with energy flows between various systems and should find broad use in present high energy density experiments.

  16. Delayed Over-Relaxation for iterative methods

    NASA Astrophysics Data System (ADS)

    Antuono, M.; Colicchio, G.

    2016-09-01

    We propose a variant of the relaxation step used in the most widespread iterative methods (e.g. Jacobi Over-Relaxation, Successive Over-Relaxation) which combines the iteration at the predicted step, namely (n + 1), with the iteration at step (n - 1). We provide a theoretical analysis of the proposed algorithm by applying such a delayed relaxation step to a generic (convergent) iterative scheme. We prove that, under proper assumptions, this significantly improves the convergence rate of the initial iterative method. As a relevant example, we apply the proposed algorithm to the solution of the Poisson equation, highlighting the advantages in comparison with classical iterative models.

  17. Lavender fragrance cleansing gel effects on relaxation.

    PubMed

    Field, Tiffany; Diego, Miguel; Hernandez-Reif, Maria; Cisneros, Wendy; Feijo, Larissa; Vera, Yanexy; Gil, Karla; Grina, Diana; Claire He, Qing

    2005-02-01

    Alertness, mood, and math computations were assessed in 11 healthy adults who sniffed a cosmetic cleansing gel with lavender floral blend aroma, developed to be relaxing using Mood Mapping. EEG patterns and heart rate were also recorded before, during, and after the aroma session. The lavender fragrance blend had a significant transient effect of improving mood, making people feel more relaxed, and performing the math computation faster. The self-report and physiological data are consistent with relaxation profiles during other sensory stimuli such as massage and music, as reported in the literature. The data suggest that a specific cosmetic fragrance can have a significant role in enhancing relaxation.

  18. Intermolecular Interactions between Eosin Y and Caffeine Using 1H-NMR Spectroscopy

    PubMed Central

    Okuom, Macduff O.; Wilson, Mark V.; Jackson, Abby; Holmes, Andrea E.

    2014-01-01

    DETECHIP has been used in testing analytes including caffeine, cocaine, and tetrahydrocannabinol (THC) from marijuana, as well as date rape and club drugs such as flunitrazepam, gamma-hydroxybutyric acid (GHB), and methamphetamine. This study investigates the intermolecular interaction between DETECHIP sensor eosin Y (DC1) and the analyte (caffeine) that is responsible for the fluorescence and color changes observed in the actual array. Using 1H-NMR, 1H-COSY, and 1H-DOSY NMR methods, a proton exchange from C-8 of caffeine to eosin Y is proposed. PMID:25018772

  19. Intermolecular Interactions between Eosin Y and Caffeine Using (1)H-NMR Spectroscopy.

    PubMed

    Okuom, Macduff O; Wilson, Mark V; Jackson, Abby; Holmes, Andrea E

    2013-12-31

    DETECHIP has been used in testing analytes including caffeine, cocaine, and tetrahydrocannabinol (THC) from marijuana, as well as date rape and club drugs such as flunitrazepam, gamma-hydroxybutyric acid (GHB), and methamphetamine. This study investigates the intermolecular interaction between DETECHIP sensor eosin Y (DC1) and the analyte (caffeine) that is responsible for the fluorescence and color changes observed in the actual array. Using (1)H-NMR, (1)H-COSY, and (1)H-DOSY NMR methods, a proton exchange from C-8 of caffeine to eosin Y is proposed. PMID:25018772

  20. Evaluation of short-TE 1H MRSI for quantification of metabolites in the prostate

    PubMed Central

    Basharat, Meer; Jafar, Maysam; deSouza, Nandita M; Payne, Geoffrey S

    2014-01-01

    Back-to-back 1H MRSI scans, using an endorectal and phased-array coil combination, were performed on 18 low-risk patients with prostate cancer at 3 T, employing TEs of 32 and 100 ms in order to compare metabolite visualization at each TE. Outer-volume suppression of lipid signals was performed using regional saturation (REST) slabs and the quantification of spectra at both TEs was achieved with the quantitation using quantum estimation (QUEST) routine. Metabolite nulling experiments in an additional five patients found that there were negligible macromolecule background signals in prostate spectra at TE = 32 ms. Metabolite visibility was judged using the criterion Cramér–Rao lower bound (CRLB)/amplitude < 20%, and metabolite concentrations were corrected for relaxation effects and referenced to the data acquired in corresponding water-unsuppressed MRSI scans. For the first time, the prostate metabolites spermine and myo-inositol were quantified individually in vivo, together with citrate, choline and creatine. All five metabolite visibilities were higher in TE = 32 ms MRSI than in TE = 100 ms MRSI. At TE = 32 ms, citrate was visible in 99.0% of lipid-free spectra, whereas, at TE = 100 ms, no metabolite simulation of citrate matched the in vivo peaks. Spermine, choline and creatine were visualised separately in 30.4% more spectra at TE = 32 ms than at TE = 100 ms, and myo-inositol in 72.5% more spectra. T2 values were calculated for spermine (53 ± 16 ms), choline (62 ± 17 ms) and myo-inositol (90 ± 48 ms). Data from the TE = 32 ms spectra showed that the concentrations of citrate and spermine secretions were positively correlated in both the peripheral zone and central gland (R2 = 0.73 and R2 = 0.43, respectively), and that the citrate content was significantly higher in the former at 64 ± 22 mm than in the latter at 32 ± 16 mm (p = 0.01). However, lipid

  1. Transverse and longitudinal angular momenta of light

    NASA Astrophysics Data System (ADS)

    Bliokh, Konstantin Y.; Nori, Franco

    2015-08-01

    We review basic physics and novel types of optical angular momentum. We start with a theoretical overview of momentum and angular momentum properties of generic optical fields, and discuss methods for their experimental measurements. In particular, we describe the well-known longitudinal (i.e., aligned with the mean momentum) spin and orbital angular momenta in polarized vortex beams. Then, we focus on the transverse (i.e., orthogonal to the mean momentum) spin and orbital angular momenta, which were recently actively discussed in theory and observed in experiments. First, the recently-discovered transverse spin angular momenta appear in various structured fields: evanescent waves, interference fields, and focused beams. We show that there are several kinds of transverse spin angular momentum, which differ strongly in their origins and physical properties. We describe extraordinary features of the transverse optical spins and overview recent experiments. In particular, the helicity-independent transverse spin inherent in edge evanescent waves offers robust spin-direction coupling at optical interfaces (the quantum spin Hall effect of light). Second, we overview the transverse orbital angular momenta of light, which can be both extrinsic and intrinsic. These two types of the transverse orbital angular momentum are produced by spatial shifts of the optical beams (e.g., in the spin Hall effect of light) and their Lorentz boosts, respectively. Our review is underpinned by a unified theory of the angular momentum of light based on the canonical momentum and spin densities, which avoids complications associated with the separation of spin and orbital angular momenta in the Poynting picture. It allows us to construct a comprehensive classification of all known optical angular momenta based on their key parameters and main physical properties.

  2. The time correlation function perspective of NMR relaxation in proteins

    NASA Astrophysics Data System (ADS)

    Shapiro, Yury E.; Meirovitch, Eva

    2013-08-01

    We applied over a decade ago the two-body coupled-rotator slowly relaxing local structure (SRLS) approach to NMR relaxation in proteins. One rotator is the globally moving protein and the other rotator is the locally moving probe (spin-bearing moiety, typically the 15N-1H bond). So far we applied SRLS to 15N-H relaxation from seven different proteins within the scope of the commonly used data-fitting paradigm. Here, we solve the SRLS Smoluchowski equation using typical best-fit parameters as input, to obtain the corresponding generic time correlation functions (TCFs). The following new information is obtained. For actual rhombic local ordering and main ordering axis pointing along C_{i - 1}^α - C_i^α, the measurable TCF is dominated by the (K,K') = (-2,2), (2,2), and (0,2) components (K is the order of the rank 2 local ordering tensor), determined largely by the local motion. Global diffusion axiality affects the analysis significantly when the ratio between the parallel and perpendicular components exceeds approximately 1.5. Local diffusion axiality has a large and intricate effect on the analysis. Mode-coupling becomes important when the ratio between the global and local motional rates falls below 0.01. The traditional method of analysis - model-free (MF) - represents a simple limit of SRLS. The conditions under which the MF and SRLS TCFs are the same are specified. The validity ranges of wobble-in-a-cone and rotation on the surface of a cone as local motions are determined. The evolution of the intricate Smoluchowski operator from the simple diffusion operator for a sphere reorienting in isotropic medium is delineated. This highlights the fact that SRLS is an extension of the established stochastic theories for treating restricted motions. This study lays the groundwork for TCF-based comparison between mesoscopic SRLS and atomistic molecular dynamics.

  3. Isometric squeeze relaxation (progressive relaxation) vs meditation: absorption and focusing as predictors of state effects.

    PubMed

    Weinstein, M; Smith, J C

    1992-12-01

    We taught isometric squeeze relaxation (a variant of progressive relaxation) or meditation to 52 anxious subjects (16 men, 36 women). For meditation, pretreatment high absorption correlated with reductions in state cognitive and somatic anxiety as well as increments in state focusing. For isometric squeeze relaxation, pretreatment low state focusing correlated with reductions in somatic anxiety and increments in focusing. Results suggest that isometric squeeze relaxation (and progressive relaxation) may be more appropriate for individuals who have difficulty focusing, and meditation for those who already possess well-developed relaxation skills at a trait level. The results appear more consistent with Smith's cognitive-behavioral model of relaxation than with Benson's relaxation response or Davidson and Schwartz's specific effects models.

  4. Zen meditation and ABC relaxation theory: an exploration of relaxation states, beliefs, dispositions, and motivations.

    PubMed

    Gillani, N B; Smith, J C

    2001-06-01

    This study is an attempt to rigorously map the psychological effects of Zen meditation among experienced practitioners. Fifty-nine Zen meditators with at least six years of experience practiced an hour of traditional Zazen seated meditation. A control group of 24 college students spent 60 min silently reading popular magazines. Before relaxation, all participants took the Smith Relaxation States Inventory (SRSI), the Smith Relaxation Dispositions/Motivations Inventory (SRD/MI), and the Smith Relaxation Beliefs Inventory (SRBI). After practice, participants again took the SRSI. Analyses revealed that meditators are less likely to believe in God, more likely to believe in Inner Wisdom, and more likely to display the relaxation dispositions Mental Quiet, Mental Relaxation, and Timeless/Boundless/Infinite. Pre- and postsession analyses revealed that meditators showed greater increments in the relaxation states Mental Quiet, Love and Thankfulness, and Prayerfulness, as well as reduced Worry. Results support Smith's ABC Relaxation Theory.

  5. Cryogenic oxygen jet response to transverse acoustic excitation with the first transverse and the first combined longitudinal-transverse modes

    NASA Astrophysics Data System (ADS)

    Hardi, J. S.; Oschwald, M.

    2016-07-01

    The intact length of the dense oxygen core from an oxygen-hydrogen shear coaxial rocket injector was measured. The measurements were made in a rectangular rocket combustor with optical access and acoustic forcing. The combustor was operated at chamber pressures of 40 and 60 bar, with either ambient temperature or cryogenic hydrogen. The multielement injection spray is subjected to forced transverse gas oscillations of two different acoustic resonance modes; the first transverse (1T) mode at 4200 Hz and the first combined longitudinal-transverse (1L1T) at 5500 Hz. Intact core length is measured from high-speed shadowgraph imaging. The dependence of intact core length with increasing acoustic amplitude is compared for the two modes of excitation.

  6. Finite-pulse radio frequency driven recoupling with phase cycling for 2D 1H/1H correlation at ultrafast MAS frequencies

    NASA Astrophysics Data System (ADS)

    Nishiyama, Yusuke; Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2014-06-01

    The first-order recoupling sequence radio frequency driven dipolar recoupling (RFDR) is commonly used in single-quantum/single-quantum homonuclear correlation 2D experiments under magic angle spinning (MAS) to determine homonuclear proximities. From previously reported analysis of the use of XY-based super-cycling schemes to enhance the efficiency of the finite-pulse-RFDR (fp-RFDR) pulse sequence, XY814 phase cycling was found to provide the optimum performance for 2D correlation experiments on low-γ nuclei. In this study, we analyze the efficiency of different phase cycling schemes for proton-based fp-RFDR experiments. We demonstrate the advantages of using a short phase cycle, XY4, and its super-cycle XY414 that only recouples the zero-quantum homonuclear dipolar coupling, for the fp-RFDR sequence in 2D 1H/1H correlation experiments at ultrafast MAS frequencies. The dipolar recoupling efficiencies of XY4, XY414 and XY814 phase cycling schemes are compared based on results obtained from 2D 1H/1H correlation experiments, utilizing the fp-RFDR pulse sequence, on powder samples of U-13C,15N-L-alanine, N-acetyl-15N-L-valyl-15N-L-leucine, and glycine. Experimental results and spin dynamics simulations show that XY414 performs the best when a high RF power is used for the 180° pulse, whereas XY4 renders the best performance when a low RF power is used. The effects of RF field inhomogeneity and chemical shift offsets are also examined. Overall, our results suggest that a combination of fp-RFDR-XY414 employed in the recycle delay with a large RF-field to decrease the recycle delay, and fp-RFDR-XY4 in the mixing period with a moderate RF-field, is a robust and efficient method for 2D single-quantum/single-quantum 1H/1H correlation experiments at ultrafast MAS frequencies.

  7. Transversity and Collins functions from SIDIS and e{sup +}e{sup -} data

    SciTech Connect

    Anselmino, M.; Boglione, M.; Prokudin, A.; Tuerk, C.; D'Alesio, U.; Murgia, F.; Kotzinian, A.

    2007-03-01

    A global analysis of the experimental data on azimuthal asymmetries in semi-inclusive deep inelastic scattering (SIDIS), from the HERMES and COMPASS Collaborations, and in e{sup +}e{sup -}{yields}h{sub 1}h{sub 2}X processes, from the Belle Collaboration, is performed. It results in the extraction of the Collins fragmentation function and, for the first time, of the transversity distribution function for u and d quarks. These turn out to have opposite signs and to be sizably smaller than their positivity bounds. Predictions for the azimuthal asymmetry A{sub UT}{sup sin({phi}{sub S}+{phi}{sub h})}, as will soon be measured at JLab and COMPASS operating on a transversely polarized proton target, are then presented.

  8. Potential role of body fluid 1H NMR metabonomics as a prognostic and diagnostic tool.

    PubMed

    Ala-Korpela, Mika

    2007-11-01

    This review briefly handles the use of (1)H NMR spectroscopy in lipoprotein subclass analytics. Potential diagnostic uses of (1)H NMR metabonomics of human serum for coronary heart disease, diabetic nephropathy and cancer are also discussed. In addition, miscellaneous recent applications of NMR metabonomics (e.g., a pharmacometabonomic tactic to personalize drug treatment) as well as multi-organ, multispecies and multi-omics approaches to molecular systems biology are featured. Some related experimental and data analysis methodologies are briefly introduced with respect to the biochemical rationales. Critical considerations on the potential diagnostic value of in vitro (1)H NMR are presented together with optimism toward the usage of body fluid (1)H NMR metabonomics in disease risk assessment and as an aid for personalized medicine.

  9. Nucleon Spin Structure: Longitudinal and Transverse

    SciTech Connect

    Jian-Ping Chen

    2011-02-01

    Inclusive Deep-Inelastic Scattering (DIS) experiments have provided us with the most extensive information on the unpolarized and longitudinal polarized parton (quark and gluon) distributions in the nucleon. It has becoming clear that transverse spin and transverse momentum dependent distributions (TMDs) study are crucial for a more complete understanding of the nucleon structure and the dynamics of the strong interaction. The transverse spin structure and the TMDs are the subject of increasingly intense theoretical and experimental study recently. With a high luminosity electron beam facility, JLab has played a major role in the worldwide effort to study both the longitudinal and transverse spin structure. Highlights of recent results will be presented. With 12-GeV energy upgrade, JLab will provide the most precise measurements in the valence quark region to close a chapter in longitudinal spin study. JLab will also perform a multi-dimensional mapping of the transverse spin structure and TMDs in the valence quark region through Semi-Inclusive DIS (SIDIS) experiments, providing a 3-d partonic picture of the nucleon in momentum space and extracting the u and d quark tensor charges of the nucleon. The precision mapping of TMDs will also allow a detailed study of the quark orbital motion and its dynamics.

  10. H2 Receptor-Mediated Relaxation of Circular Smooth Muscle in Human Gastric Corpus: the Role of Nitric Oxide (NO).

    PubMed

    Lee, Sang Eok; Kim, Dae Hoon; Kim, Young Chul; Han, Joung-Ho; Choi, Woong; Kim, Chan Hyung; Jeong, Hye Won; Park, Seon-Mee; Yun, Sei Jin; Choi, Song-Yi; Sung, Rohyun; Kim, Young Ho; Yoo, Ra Young; Sun, Park Hee; Kim, Heon; Song, Young-Jin; Xu, Wen-Xie; Yun, Hyo-Yung; Lee, Sang Jin

    2014-10-01

    This study was designed to examine the effects of histamine on gastric motility and its specific receptor in the circular smooth muscle of the human gastric corpus. Histamine mainly produced tonic relaxation in a concentration-dependent and reversible manner, although histamine enhanced contractility in a minor portion of tissues tested. Histamine-induced tonic relaxation was nerve-insensitive because pretreatment with nerve blockers cocktail (NBC) did not inhibit relaxation. Additionally, K(+) channel blockers, such as tetraethylammonium (TEA), apamin (APA), and glibenclamide (Glib), had no effect. However, N(G)-nitro-L-arginine methyl ester (L-NAME) and 1H-(1,2,4)oxadiazolo (4,3-A) quinoxalin-1-one (ODQ), an inhibitor of soluble guanylate cyclase (sGC), did inhibit histamine-induced tonic relaxation. In particular, histamine-induced tonic relaxation was converted to tonic contraction by pretreatment with L-NAME. Ranitidine, the H2 receptor blocker, inhibited histamine-induced tonic relaxation. These findings suggest that histamine produced relaxation in circular smooth muscle of human gastric smooth muscle through H2 receptor and NO/sGC pathways.

  11. H2 Receptor-Mediated Relaxation of Circular Smooth Muscle in Human Gastric Corpus: the Role of Nitric Oxide (NO)

    PubMed Central

    Lee, Sang Eok; Kim, Dae Hoon; Han, Joung-Ho; Choi, Woong; Kim, Chan Hyung; Jeong, Hye Won; Park, Seon-Mee; Yun, Sei Jin; Choi, Song-Yi; Sung, Rohyun; Kim, Young Ho; Yoo, Ra Young; Sun, Park Hee; Kim, Heon; Song, Young-Jin; Xu, Wen-Xie; Lee, Sang Jin

    2014-01-01

    This study was designed to examine the effects of histamine on gastric motility and its specific receptor in the circular smooth muscle of the human gastric corpus. Histamine mainly produced tonic relaxation in a concentration-dependent and reversible manner, although histamine enhanced contractility in a minor portion of tissues tested. Histamine-induced tonic relaxation was nerve-insensitive because pretreatment with nerve blockers cocktail (NBC) did not inhibit relaxation. Additionally, K+ channel blockers, such as tetraethylammonium (TEA), apamin (APA), and glibenclamide (Glib), had no effect. However, NG-nitro-L-arginine methyl ester (L-NAME) and 1H-(1,2,4)oxadiazolo (4,3-A) quinoxalin-1-one (ODQ), an inhibitor of soluble guanylate cyclase (sGC), did inhibit histamine-induced tonic relaxation. In particular, histamine-induced tonic relaxation was converted to tonic contraction by pretreatment with L-NAME. Ranitidine, the H2 receptor blocker, inhibited histamine-induced tonic relaxation. These findings suggest that histamine produced relaxation in circular smooth muscle of human gastric smooth muscle through H2 receptor and NO/sGC pathways. PMID:25352763

  12. H2 Receptor-Mediated Relaxation of Circular Smooth Muscle in Human Gastric Corpus: the Role of Nitric Oxide (NO).

    PubMed

    Lee, Sang Eok; Kim, Dae Hoon; Kim, Young Chul; Han, Joung-Ho; Choi, Woong; Kim, Chan Hyung; Jeong, Hye Won; Park, Seon-Mee; Yun, Sei Jin; Choi, Song-Yi; Sung, Rohyun; Kim, Young Ho; Yoo, Ra Young; Sun, Park Hee; Kim, Heon; Song, Young-Jin; Xu, Wen-Xie; Yun, Hyo-Yung; Lee, Sang Jin

    2014-10-01

    This study was designed to examine the effects of histamine on gastric motility and its specific receptor in the circular smooth muscle of the human gastric corpus. Histamine mainly produced tonic relaxation in a concentration-dependent and reversible manner, although histamine enhanced contractility in a minor portion of tissues tested. Histamine-induced tonic relaxation was nerve-insensitive because pretreatment with nerve blockers cocktail (NBC) did not inhibit relaxation. Additionally, K(+) channel blockers, such as tetraethylammonium (TEA), apamin (APA), and glibenclamide (Glib), had no effect. However, N(G)-nitro-L-arginine methyl ester (L-NAME) and 1H-(1,2,4)oxadiazolo (4,3-A) quinoxalin-1-one (ODQ), an inhibitor of soluble guanylate cyclase (sGC), did inhibit histamine-induced tonic relaxation. In particular, histamine-induced tonic relaxation was converted to tonic contraction by pretreatment with L-NAME. Ranitidine, the H2 receptor blocker, inhibited histamine-induced tonic relaxation. These findings suggest that histamine produced relaxation in circular smooth muscle of human gastric smooth muscle through H2 receptor and NO/sGC pathways. PMID:25352763

  13. One-Pot Synthesis of Substituted Trifluoromethylated 2,3-Dihydro-1H-imidazoles.

    PubMed

    Deutsch, Amrei; Jessen, Christoph; Deutsch, Carl; Karaghiosoff, Konstantin; Hoffmann-Röder, Anja

    2016-07-15

    An operationally simple one-pot reaction for the preparation of a novel class of racemic trifluoromethylated 2,3-dihydro-1H-imidazoles derived from electron-poor N,O-acetals and aryl Grignard reagents is described. In addition, access to highly functionalized 2-trifluoromethyl-2,3-dihydro-1H-imidazoles was accomplished by reaction of N-aryl hemiaminal ethers and N-aryl trifluoroethylamines in the presence of an excess of n-butyllithium. PMID:27359260

  14. Measurements of heavy-atom isotope effects using 1H NMR spectroscopy.

    PubMed

    Pabis, Anna; Kamiński, Rafał; Ciepielowski, Grzegorz; Jankowski, Stefan; Paneth, Piotr

    2011-10-01

    A novel method for measuring heavy-atom KIEs for magnetically active isotopes using (1)H NMR is presented. It takes advantage of the resonance split of the protons coupled with the heavy atom in the (1)H spectrum. The method is validated by the example of the (13)C-KIE on the hydroamination of styrene with aniline, catalyzed by phosphine-ligated palladium triflates.

  15. Complete 1H, 15N and 13C assignment of trappin-2 and 1H assignment of its two domains, elafin and cementoin.

    PubMed

    Loth, Karine; Alami, Soha Abou Ibrahim; Habès, Chahrazed; Garrido, Solène; Aucagne, Vincent; Delmas, Agnès F; Moreau, Thierry; Zani, Marie-Louise; Landon, Céline

    2016-04-01

    Trappin-2 is a serine protease inhibitor with a very narrow inhibitory spectrum and has significant anti-microbial activities. It is a 10 kDa cationic protein composed of two distinct domains. The N-terminal domain (38 residues) named cementoin is known to be intrinsically disordered when it is not linked to the elafin. The C-terminal domain (57 residues), corresponding to elafin, is a cysteine-rich domain stabilized by four disulfide bridges and is characterized by a flat core and a flexible N-terminal part. To our knowledge, there is no structural data available on trappin-2. We report here the complete (1)H, (15)N and (13)C resonance assignment of the recombinant trappin-2 and the (1)H assignments of cementoin and elafin, under the same experimental conditions. This is the first step towards the 3D structure determination of the trappin-2.

  16. Magnesium Silicate Dissolution Investigated by 29Si MAS, 1H-29Si CP MAS, 25Mg QCPMG, and 1H-25Mg CP QCPMG NMR

    SciTech Connect

    Davis, Michael C.; Brouwer, William J.; Wesolowski, David J.; Anovitz, Lawrence M.; Lipton, Andrew S.; Mueller, Karl T.

    2009-08-01

    Olivine has been the subject of frequent investigation in the earth sciences because of its simple structure and rapid dissolution kinetics. Several studies have observed a preferential release of magnesium with respect to silica during weathering under acidic conditions, which has been correlated to the formation of a silicon rich leached layer. While leached layer formation has been inferred through the changing solution chemistry, a thorough spectroscopic investigation of olivine reacted under acidic conditions has not been conducted. In particular, the fate of magnesium in the system is not understood and spectroscopic interrogations through nuclear magnetic resonance can elucidate the changing magnesium coordination and bonding environment. In this study, we combine analysis of the changing solution chemistry with advanced spectroscopic techniques (29Si MAS, 1H-29Si CP MAS, 25Mg QCPMG, and 1H-25Mg 2 CP QCPMG NMR) to probe leached layer formation and possible secondary phase precipitation during the dissolution of forsterite at 150 oC.

  17. Determination of glucan phosphorylation using heteronuclear 1H, 13C double and 1H, 13C, 31P triple-resonance NMR spectra.

    PubMed

    Schmieder, Peter; Nitschke, Felix; Steup, Martin; Mallow, Keven; Specker, Edgar

    2013-10-01

    Phosphorylation and dephosphorylation of starch and glycogen are important for their physicochemical properties and also their physiological functions. It is therefore desirable to reliably determine the phosphorylation sites. Heteronuclear multidimensional NMR-spectroscopy is in principle a straightforward analytical approach even for complex carbohydrate molecules. With heterogeneous samples from natural sources, however, the task becomes more difficult because a full assignment of the resonances of the carbohydrates is impossible to obtain. Here, we show that the combination of heteronuclear (1) H,(13) C and (1) H,(13) C,(31) P techniques and information derived from spectra of a set of reference compounds can lead to an unambiguous determination of the phosphorylation sites even in heterogeneous samples. PMID:23913630

  18. Bioinspired, cysteamine-catalyzed co-silicification of (1H, 1H, 2H, 2HPerfluorooctyl) triethoxysilane and tetraethyl orthosilicate: formation of superhydrophobic surfaces.

    PubMed

    Park, Ji Hun; Kim, Ji Yup; Cho, Woo Kyung; Choi, Insung S

    2014-03-01

    Bioinspired silicification attracts a great deal of interest because of its physiologically relevant, mild conditions for hydrolysis and condensation of silica precursors, which makes the bioinspired approach superior to the conventional sol–gel process, particularly when dealing with biological entities. However, the morphological control of silica structures with incorporation of functional groups in the bioinspired silicilication has been unexplored. In this work, we co-silicificated (1H, 1H, 2H, 2H-perfluorooctyl)triethoxysilane and tetraethyl orthosilicate to investigate the morphological evolution of fluorinated silica structures in the cetyltrimethylammonium bromide-mediated, cysteamine-catalyzed silicification. The generated micrometer-long wormlike and spherical silica structures display superhydrophobicity after film formation. Interestingly, the measurement of dynamic water contact angles shows that the morphological difference leads to a different wetting state, either the self-cleaning or the pinning state of the superhydrophobic surface.

  19. Determination of glucan phosphorylation using heteronuclear 1H, 13C double and 1H, 13C, 31P triple-resonance NMR spectra.

    PubMed

    Schmieder, Peter; Nitschke, Felix; Steup, Martin; Mallow, Keven; Specker, Edgar

    2013-10-01

    Phosphorylation and dephosphorylation of starch and glycogen are important for their physicochemical properties and also their physiological functions. It is therefore desirable to reliably determine the phosphorylation sites. Heteronuclear multidimensional NMR-spectroscopy is in principle a straightforward analytical approach even for complex carbohydrate molecules. With heterogeneous samples from natural sources, however, the task becomes more difficult because a full assignment of the resonances of the carbohydrates is impossible to obtain. Here, we show that the combination of heteronuclear (1) H,(13) C and (1) H,(13) C,(31) P techniques and information derived from spectra of a set of reference compounds can lead to an unambiguous determination of the phosphorylation sites even in heterogeneous samples.

  20. Proton-detected 3D {sup 1}H/{sup 13}C/{sup 1}H correlation experiment for structural analysis in rigid solids under ultrafast-MAS above 60 kHz

    SciTech Connect

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy; Nishiyama, Yusuke

    2015-10-28

    A proton-detected 3D {sup 1}H/{sup 13}C/{sup 1}H chemical shift correlation experiment is proposed for the assignment of chemical shift resonances, identification of {sup 13}C-{sup 1}H connectivities, and proximities of {sup 13}C-{sup 1}H and {sup 1}H-{sup 1}H nuclei under ultrafast magic-angle-spinning (ultrafast-MAS) conditions. Ultrafast-MAS is used to suppress all anisotropic interactions including {sup 1}H-{sup 1}H dipolar couplings, while the finite-pulse radio frequency driven dipolar recoupling (fp-RFDR) pulse sequence is used to recouple dipolar couplings among protons and the insensitive nuclei enhanced by polarization transfer technique is used to transfer magnetization between heteronuclear spins. The 3D experiment eliminates signals from non-carbon-bonded protons and non-proton-bonded carbons to enhance spectral resolution. The 2D (F1/F3) {sup 1}H/{sup 1}H and 2D {sup 13}C/{sup 1}H (F2/F3) chemical shift correlation spectra extracted from the 3D spectrum enable the identification of {sup 1}H-{sup 1}H proximity and {sup 13}C-{sup 1}H connectivity. In addition, the 2D (F1/F2) {sup 1}H/{sup 13}C chemical shift correlation spectrum, incorporated with proton magnetization exchange via the fp-RFDR recoupling of {sup 1}H-{sup 1}H dipolar couplings, enables the measurement of proximities between {sup 13}C and even the remote non-carbon-bonded protons. The 3D experiment also gives three-spin proximities of {sup 1}H-{sup 1}H-{sup 13}C chains. Experimental results obtained from powder samples of L-alanine and L-histidine ⋅ H{sub 2}O ⋅ HCl demonstrate the efficiency of the 3D experiment.

  1. Coinhibitory receptor PD-1H preferentially suppresses CD4+ T cell–mediated immunity

    PubMed Central

    Flies, Dallas B.; Han, Xue; Higuchi, Tomoe; Zheng, Linghua; Sun, Jingwei; Ye, Jessica Jane; Chen, Lieping

    2014-01-01

    T cell activation is regulated by the interactions of surface receptors with stimulatory and inhibitory ligands. Programmed death-1 homolog (PD-1H, also called VISTA) is a member of the CD28 family of proteins and has been shown to act as a coinhibitory ligand on APCs that suppress T cell responses. Here, we determined that PD-1H functions as a coinhibitory receptor for CD4+ T cells. CD4+ T cells in mice lacking PD-1H exhibited a dramatically increased response to antigen stimulation. Furthermore, delivery of a PD-1H–specific agonist mAb directly inhibited CD4+ T cell activation both in vitro and in vivo, validating a coinhibitory function of PD-1H. In a murine model of acute hepatitis, administration of a PD-1H agonist mAb suppressed CD4+ T cell–mediated acute inflammation. PD-1H–deficient animals were highly resistant to tumor induction in a murine brain glioma model, and depletion of CD4+ T cells, but not CD8+ T cells, promoted tumor formation. Together, our findings suggest that PD-1H has potential as a target of immune modulation in the treatment of human inflammation and malignancies. PMID:24743150

  2. Dynamic transverse shear modulus for a heterogeneous fluid-filled porous solid containing cylindrical inclusions

    NASA Astrophysics Data System (ADS)

    Song, Yongjia; Hu, Hengshan; Rudnicki, John W.; Duan, Yunda

    2016-06-01

    An exact analytical solution is presented for the effective dynamic transverse shear modulus in a heterogeneous fluid-filled porous solid containing cylindrical inclusions. The complex and frequency-dependent properties of the dynamic shear modulus are caused by the physical mechanism of mesoscopic-scale wave-induced fluid flow whose scale is smaller than wavelength but larger than the size of pores. Our model consists of three phases: a long cylindrical inclusion, a cylindrical shell of poroelastic matrix material with different mechanical and/or hydraulic properties than the inclusion and an outer region of effective homogeneous medium of laterally infinite extent. The behavior of both the inclusion and the matrix is described by Biot's consolidation equations, whereas the surrounding effective medium which is used to describe the effective transverse shear properties of the inner poroelastic composite is assumed to be a viscoelastic solid whose complex transverse shear modulus needs to be determined. The determined effective transverse shear modulus is used to quantify the S-wave attenuation and velocity dispersion in heterogeneous fluid-filled poroelastic rocks. The calculation shows the relaxation frequency and relative position of various fluid saturation dispersion curves predicted by this study exhibit very good agreement with those of a previous two-dimensional finite-element simulation. For the double-porosity model (inclusions having a different solid frame than the matrix but the same pore fluid as the matrix) the effective shear modulus also exhibits a size-dependent characteristic that the relaxation frequency moves to lower frequencies by two orders of magnitude if the radius of the cylindrical poroelastic composite increases by one order of magnitude. For the patchy-saturation model (inclusions having the same solid frame as the matrix but with a different pore fluid from the matrix), the heterogeneity in pore fluid cannot cause any attenuation in

  3. Dynamic transverse shear modulus for a heterogeneous fluid-filled porous solid containing cylindrical inclusions

    NASA Astrophysics Data System (ADS)

    Song, Yongjia; Hu, Hengshan; Rudnicki, John W.; Duan, Yunda

    2016-09-01

    An exact analytical solution is presented for the effective dynamic transverse shear modulus in a heterogeneous fluid-filled porous solid containing cylindrical inclusions. The complex and frequency-dependent properties of the dynamic shear modulus are caused by the physical mechanism of mesoscopic-scale wave-induced fluid flow whose scale is smaller than wavelength but larger than the size of pores. Our model consists of three phases: a long cylindrical inclusion, a cylindrical shell of poroelastic matrix material with different mechanical and/or hydraulic properties than the inclusion and an outer region of effective homogeneous medium of laterally infinite extent. The behavior of both the inclusion and the matrix is described by Biot's consolidation equations, whereas the surrounding effective medium which is used to describe the effective transverse shear properties of the inner poroelastic composite is assumed to be a viscoelastic solid whose complex transverse shear modulus needs to be determined. The determined effective transverse shear modulus is used to quantify the S-wave attenuation and velocity dispersion in heterogeneous fluid-filled poroelastic rocks. The calculation shows the relaxation frequency and relative position of various fluid saturation dispersion curves predicted by this study exhibit very good agreement with those of a previous 2-D finite-element simulation. For the double-porosity model (inclusions having a different solid frame than the matrix but the same pore fluid as the matrix) the effective shear modulus also exhibits a size-dependent characteristic that the relaxation frequency moves to lower frequencies by two orders of magnitude if the radius of the cylindrical poroelastic composite increases by one order of magnitude. For the patchy-saturation model (inclusions having the same solid frame as the matrix but with a different pore fluid from the matrix), the heterogeneity in pore fluid cannot cause any attenuation in the

  4. High-frequency longitudinal and transverse dynamics in water

    SciTech Connect

    Pontecorvo, E.; Ruocco, G.; Krisch, M.; Monaco, G.; Mermet, A.; Verbeni, R.; Sette, F.; Cunsolo, A.

    2005-01-01

    High-resolution, inelastic x-ray scattering measurements of the dynamic structure factor S(Q,{omega}) of liquid water have been performed for wave vectors Q between 4 and 30 nm{sup -1} in distinctly different thermodynamic conditions (T=263-420 K; at, or close to, ambient pressure and at P=2 kbar). In agreement with previous inelastic x-ray and neutron studies, the presence of two inelastic contributions (one dispersing with Q and the other almost nondispersive) is confirmed. The study of their temperature and Q dependence provides strong support for a dynamics of liquid water controlled by the structural relaxation process. A viscoelastic analysis of the Q-dispersing mode, associated with the longitudinal dynamics, reveals that the sound velocity undergoes a complete transition from the adiabatic sound velocity (c{sub 0}) (viscous limit) to the infinite-frequency sound velocity (c{sub {infinity}}) (elastic limit). On decreasing Q, as the transition regime is approached from the elastic side, we observe a decrease of the intensity of the second, weakly dispersing feature, which completely disappears when the viscous regime is reached. These findings unambiguously identify the second excitation to be a signature of the transverse dynamics with a longitudinal symmetry component, which becomes visible in S(Q,{omega}) as soon as the purely viscous regime is left.

  5. Analysis of sawtooth relaxation oscillations in tokamaks

    SciTech Connect

    Yamazaki, K.; McGuire, K.; Okabayashi, M.

    1982-07-01

    Sawtooth relaxation oscillations are analyzed using the Kadomtsev's disruption model and a thermal relaxation model. The sawtooth period is found to be very sensitive to the thermal conduction loss. Qualitative agreement between these calculations and the sawtooth period observed in several tokamaks is demonstrated.

  6. Transverse Bursts in Inclined Layer Convection: Experiment

    NASA Astrophysics Data System (ADS)

    Daniels, Karen; Wiener, Richard; Bodenschatz, Eberhard

    2002-03-01

    We report experimental results on inclined layer convection in a fluid of Prandtl number σ ≈ 1. A codimension-two point divides regions of buoyancy-driven convection (longitudinal rolls) at lower angles from shear-driven convection (transverse rolls) at higher angles (Daniels et al. PRL 84: 5320, 2000). In the region of buoyancy-driven convection, near the codimension-two point, we observe longitudinal rolls with intermittent, localized, subharmonic transverse bursts. The patterns are spatiotemporally chaotic. With increasing temperature difference the bursts increase in duration and number. We examine the details of the bursting process (e.g. the energy of longitudinal, transverse, and mixed modes) and compare our results to bursting processes in other systems. This work is supported by the National Science Foundation under grant DMR-0072077 and the IGERT program in nonlinear systems, grant DGE-9870631.

  7. Transverse Ising model with multi-impurity

    NASA Astrophysics Data System (ADS)

    Huang, Xuchu; Yang, Zhihua

    2015-05-01

    We study the transverse Ising spin model with spin-1 impurities under the exact solution. We develop a universal method to deal with the multi-impurity problem by introducing a displacement quantity in the wave function and get a recursive formula to simplify the calculation of the partition function. This allows us to rigorously determine the impurity effects for a specific distribution of impurity in the thermodynamic limit. The low temperature behaviors are governed by the interplay between host and impurity excitations, and the quantum critical fluctuations around the critical point of the transverse Ising model are tuned by the transverse field and the concentration of impurity. However the impurity effects are limited, which depends on the host-impurity exchange interaction and the coupling strength of impurities.

  8. Efficient modeling in transversely isotropic inhomogeneous media

    SciTech Connect

    Alkhalifah, T.

    1993-11-01

    An efficient modeling technique for transversely isotropic, inhomogeneous media, is developed using a mix of analytical equations and numerical calculations. The analytic equation for the raypath in a factorized transversely isotropic (FTI) media with linear velocity variation, derived by Shearer and Chapman, is used to trace between two points. In addition, I derive an analytical equation for geometrical spreading in FTI media that aids in preserving program efficiency; however, the traveltime is calculated numerically. I then generalize the method to treat general transversely isotropic (TI) media that are not factorized anisotropic inhomogeneous by perturbing the FTI traveltimes, following the perturbation ideas of Cerveny and Filho. A Kirchhoff-summation-based program relying on Trorey`s (1970) diffraction method is used to generate synthetic seismograms for such a medium. For the type of velocity models treated, the program is much more efficient than finite-difference and general ray-trace modeling techniques.

  9. Evolution of transverse modes in FELIX macropulses

    SciTech Connect

    Weits, H.H.; Lin, L.; Werkhoven, G.H.C. van

    1995-12-31

    We present ringdown measurements of both the intracavity beam, using a low reflection beamsplitter, as well as the hole-outcoupled beam of FELIX, the intracavity measurements being taken at various sets of transverse coordinates. Recent measurements show a significant difference in the decay of the signals at different radial positions, suggesting the presence of higher order transverse modes. The formation of transverse modes depends on the properties of the cold cavity and its losses (i.e. resonator parameters, diffraction and outcoupling at the hole, absorption and edge losses on the mirrors, waveguide clipping), as well as on the gain mechanism. Both simulations with the axisymmetric ELIXER code and previous hole-outcoupled measurements indicated a substantial energy content of the 2nd or 4th Gauss-Laguerre (GL) mode for the 20-30 {mu}m regime of FELIX. Moreover, as FELIX has a phase degenerate cavity, the fundamental and higher order transverse modes can interplay to create a reduced outcoupling efficiency at the hole. For example, in contrast to the decay rate of 13% per roundtrip that we would expect for a pure gaussian beam when we include a loss of 6% for the reflection at the intracavity beamsplitter, recent simulations indicate a decay rate as high as 23% of the hole-outcoupled signal. In this case the 2nd order GL mode contains 30% of the total intracavity power. The effect of transverse modes on subpulses in the limit cycle regime is an interesting aspect. As soon as a subpulse is losing contact with the electrons, its transverse pattern will exhibit an on-axis hole after a few roundtrips, according to the simulations. This process could mean that the subpulses are less pronounced in the hole-outcoupled signal of FELIX 1.

  10. Enthalpy relaxation and annealing effect in polystyrene.

    PubMed

    Sakatsuji, Waki; Konishi, Takashi; Miyamoto, Yoshihisa

    2013-07-01

    The effects of thermal history on the enthalpy relaxation in polystyrene are studied by differential scanning calorimetry. The temperature dependence of the specific heat in the liquid and the glassy states, that of relaxation time, and the exponent of the Kohlrausch-Williams-Watts function are determined by measurements of the thermal response against sinusoidal temperature variation. A phenomenological model equation previously proposed to interpret the memory effect in the frozen state is applied to the enthalpy relaxation and the evolution of entropy under a given thermal history is calculated. The annealing below the glass transition temperature produces two effects on enthalpy relaxation: the decay of excess entropy with annealing time in the early stage of annealing and the increase in relaxation time due to physical aging in the later stage. The crossover of these effects is reflected in the variation of temperature of the maximum specific heat observed in the heating process after annealing and cooling.

  11. Transverse dune trailing ridges and vegetation succession

    NASA Astrophysics Data System (ADS)

    Hesp, Patrick A.; ‘Marisa' Martinez, M. L.

    2008-07-01

    We describe the evolution of, and vegetation succession on, a previously undescribed landform: transverse dune trailing ridges at El Farallón transgressive dunefield in the state of Veracruz, Mexico. Three-dimensional clinometer/compass and tape topographic surveys were conducted in conjunction with 1 m 2 contiguous percent cover and presence/absence vegetation survey transects at eight locations across two adjacent trailing ridges. At the study site, and elsewhere, the transverse dune trailing ridges are formed by vegetation colonization of the lateral margins of active transverse, barchanoidal transverse, and aklé or network dunes. For simplicity, all trailing ridges formed from these dune types are referred to as transverse dune trailing ridges. Because there are several transverse dunes in the dunefield, multiple trailing ridges can be formed at one time. Two adjacent trailing ridges were examined. The shortest length ridge was 70 m long, and evolving from a 2.5 m-high transverse dune, while the longer ridge was 140 m long, and evolving from an 8 m-high dune. Trailing ridge length is a proxy measure of ridge age, since the longer the ridge, the greater the length of time since initial formation. With increasing age or distance upwind, species diversity increased, as well as species horizontal extent and percent cover. In turn, the degree of bare sand decreased. Overall, the data indicate a successional trend in the vegetation presence and cover with increasing age upwind. Those species most tolerant to burial ( Croton and Palafoxia) begin the process of trailing ridge formation. Ipomoea and Canavalia are less tolerant to burial and also are typically the next colonizing species. Trachypogon does not tolerate sand burial or deposition very well and only appears after significant stabilization has taken place. The ridges display a moderately defined successional sequence in plant colonization and percentage cover with time (and upwind distance). They are

  12. Surface transverse waves: properties, devices, and analysis.

    PubMed

    Strashilov, Vesseline L; Yantchev, Ventsislav M

    2005-05-01

    Surface transverse waves represent a new generation of the surface acoustic wave (SAW) family that offers advantageous properties without further demand for new materials or improved design and technology. The most effective activity in the surface transverse wave (STW) area has been realized during the last decade with high-performance devices achieved and analytical methods developed. The present paper reviews the basic achievements in historical and factual order. A state-of-the-art introduction is combined with discussion on the development tendencies with specific emphasis on sensor technology.

  13. 1H DNP at 1.4 T of water doped with a triarylmethyl-based radical.

    PubMed

    Wind, R A; Ardenkjaer-Larsen, J H

    1999-12-01

    Recently a triarylmethyl-based (TAM) radical has been developed for research in biological and other aqueous systems, and in low magnetic fields, 10 mT or less, large (1)H dynamic nuclear polarization (DNP) enhancements have been reported. In this paper the DNP properties of this radical have been investigated in a considerably larger field of 1.4 T, corresponding to proton and electron Larmor frequencies of 60 MHz and 40 GHz, respectively. To avoid excessive microwave heating of the sample, an existing DNP NMR probe was modified with a screening coil, wound around the sample capillary and with its axis perpendicular to the electric component of the microwave field. It was found that with this probe the temperature increase in the sample after 4 s of microwave irradiation with an incident power of 10 W was only 16 degrees C. For the investigations, 10 mM of the TAM radical was dissolved in deionized, but not degassed, water and put into a 1-mm i.d. and 6-mm long capillary tube. At 26 degrees C the following results were obtained: (I) The relaxivity of the radical is 0.07 (mMs)(-1), in accordance with the value extrapolated from low-field results; (II) The leakage factor is 0.63, the saturation factor at maximum power is 0.85, and the coupling factor is -0.0187. It is shown that these results agree very well with an analysis where the electron-dipolar interactions are the dominant DNP mechanism, and where the relaxation transitions resulting from these interactions are governed by translational diffusion of the water molecules. Finally, the possibilities of combining DNP with magnetic resonance microscopy (MRM) are discussed. It is shown that at 26 degrees C the overall DNP-enhanced proton polarization should become maximal in an external field of 0.3 T and become comparable to the thermal equilibrium polarization in a field of 30 T, considerably larger than the largest high-resolution magnet available to date. It is concluded that DNP MRM in this field, which

  14. Postseismic relaxation and transient creep

    USGS Publications Warehouse

    Savage, J.C.; Svarc, J.L.; Yu, S.-B.

    2005-01-01

    Postseismic deformation has been observed in the epicentral area following the 1992 Landers (M = 7.3), 1999 Chi-Chi (M = 7.6), 1999 Hector Mine (M = 7.1), 2002 Denali (M = 7.9), 2003 San Simeon (M = 6.5), and 2004 Parkfield (M = 6.0) earthquakes. The observations consist of repeated GPS measurements of the position of one monument relative to another (separation ???100 km). The early observations (t < 0.1 year) are well fit by the function a' + c'log(t), where t is the time after the earthquake and a' and c' are constants chosen to fit the data. Because a log(t) time dependence is characteristic of transient (primary) creep, the early postseismic response may be governed by transient creep as Benioff proposed in 1951. That inference is provisional as the stress conditions prevailing in postseismic relaxation are not identical to the constant stress condition in creep experiments. The observed logarithmic time dependence includes no characteristic time that might aid in identifying the micromechanical cause.

  15. Superconducting plate in a transverse magnetic field: New state

    SciTech Connect

    Batyev, E. G.

    2012-07-15

    A model is proposed for describing Cooper pairs near the transition (in temperature and magnetic field) point when their spacing is larger than their size. The essence of the model is as follows: the Ginzburg-Landau functional is written in operator form in terms of field operators of the Bose type so that the average value of the density operator gives the concentration of Cooper pairs, and the same Ginzburg-Landau expression is obtained for the Bose condensate. The model is applied to a superconducting plate with a thickness smaller than the size of a pair in a transverse magnetic field near its upper critical value H{sub c2}. A new state is discovered that is energetically more advantageous in a certain interval in the vicinity of the transition point as compared to the Abrikosov vortex state. The wavefunction of the system in this state is of the type of the Laughlin function used in the fractional quantum Hall effect (naturally, as applied to Cooper pairs as Bose particles in our case) and corresponds to a homogeneous incompressible fluid. The energy of this state is proportional to the first power of quantity (1 - H/H{sub c2}) in contrast to the energy of the vortex state containing the square of this quantity. The interval of the existence of the new state is the larger, the dirtier the sample.

  16. An optimized transversely isotropic, hyper-poro-viscoelastic finite element model of the meniscus to evaluate mechanical degradation following traumatic loading

    PubMed Central

    Wheatley, Benjamin B.; Fischenich, Kristine M.; Button, Keith D.; Haut, Roger C.; Haut Donahue, Tammy L.

    2015-01-01

    Inverse finite element (FE) analysis is an effective method to predict material behavior, evaluate mechanical properties, and study differences in biological tissue function. The meniscus plays a key role in load distribution within the knee joint and meniscal degradation is commonly associated with the onset of osteoarthritis. In the current study, a novel transversely isotropic hyper-poro-viscoelastic constitutive formulation was incorporated in a FE model to evaluate changes in meniscal material properties following tibiofemoral joint impact. A non-linear optimization scheme was used to fit the model output to indentation relaxation experimental data. This study is the first to investigate rate of relaxation in healthy versus impacted menisci. Stiffness was found to be decreased (p=0.003), while the rate of tissue relaxation increased (p=0.010) at twelve weeks post impact. Total amount of relaxation, however, did not change in the impacted tissue (p=0.513). PMID:25776872

  17. [Desmin content and transversal stiffness of the left ventricle mouse cardiomyocytes and skeletal muscle fibers after a 30-day space flight on board "BION-M1" biosatellite].

    PubMed

    Ogneva, I V; Maximova, M V; Larina, I M

    2014-01-01

    The aim of this study was to determine the transversal stiffness of the cortical cytoskeleton and the cytoskeletal protein desmin content in the left ventricle cardiomyocytes, fibers of the mouse soleus and tibialis anterior muscle after a 30-day space flight on board the "BION-M1" biosatellite (Russia, 2013). The dissection was made after 13-16.5 h after landing. The transversal stiffness was measured in relaxed and calcium activated state by, atomic force microscopy. The desmin content was estimated by western blotting, and the expression level of desmin-coding gene was detected using real-time PCR. The results indicate that, the transversal stiffness of the left ventricle cardiomyocytes and fibers of the soleus muscle in relaxed and activated states did not differ from the control. The transversal stiffness of the tibialis muscle fibers in relaxed and activated state was increased in the mice group after space flight. At the same time, in all types of studied tissues the desmin content and the expression level of desmin-coding gene did not differ from the control level.

  18. Characterization of Free Surface-Bound and Entrapped Water Environments in Poly(N-Isopropyl Acrylamide) Hydrogels via 1H HRMAS PFG NMR Spectroscopy

    DOE PAGES

    Alam, Todd Michael; Childress, Kimberly Kay; Pastoor, Kevin; Rice, Charles

    2014-09-19

    We found that different water environments in poly(N-isopropyl acrylamide) (PNIPAAm) hydrogels are identified and characterized using 1H high resolution magic angle spinning (HRMAS) nuclear magnetic resonance (NMR). Local water environments corresponding to a “free” highly mobile species, along with waters showing restricted dynamics are resolved in these swollen hydro-gels. For photo-initiated polymerized PNIPAAm gels, an additional entrapped water species is observed. Spin–spin R2 relaxation experiments support the argument of reduced mobility in the restricted and entrapped water species. Furthermore, by combining pulse field gradient techniques with HRMAS NMR it is possible to directly measure the self-diffusion rate for these differentmore » water environments. The behavior of the heterogeneous water environments through the lower critical solution temperature transition is described.« less

  19. Transverse instability digital damper for the Recycler

    SciTech Connect

    Balbekov, V.; /Fermilab

    2006-02-01

    Transverse beam instability of a coasting beam with a digital damper is examined. Threshold of instability is calculated in specific cases with Landau damping taken into account. The results are applied to the Fermilab Recycler Ring. Some improvement of existing RR damper is proposed.

  20. Variation of transverse momentum in hadronic collisions

    NASA Technical Reports Server (NTRS)

    Saint Amand, J.; Uritam, R. A.

    1975-01-01

    The paper presents a detailed parameterization of the transverse momentum in hadronic collisions on multiplicity and on beam momentum. Hadronic collisions are considered at energies below the ultra-high energy domain, on the basis of an uncertainty relation and a naive eikonal model with an impact-parameter-dependent multiplicity.

  1. Transversal filter for parabolic phase equalization

    NASA Technical Reports Server (NTRS)

    Kelly, Larry R. (Inventor); Waugh, Geoffrey S. (Inventor)

    1993-01-01

    An equalizer (10) for removing parabolic phase distortion from an analog signal (3), utilizing a pair of series connected transversal filters. The parabolic phase distortion is cancelled by generating an inverse parabolic approximation using a sinusoidal phase control filter (18). The signal (3) is then passed through an amplitude control filter (21) to remove magnitude ripple components.

  2. Transverse ligament of the knee in humans.

    PubMed

    Ratajczak, Wojciech; Jakubowicz, Marian; Pytel, Andrzej

    2003-01-01

    The purpose of this study was to trace the histological structure of the transverse ligament of the knee and its relation to the inferior lateral genicular artery. Investigations were carried out on 20 lower limbs (10 males, and 10 females) from the Department of Anatomy. It was found that close to the attachment of the transverse ligament to the menisci, bundles of fibres pass in vertical, oblique and horizontal directions, occupying a wide area on the anterior margin of the menisci. These fibres intermingle with bundles of the fibrocartilage of the menisci. In the area of the lateral attachment the inferior lateral genicular artery passes anteriorly to the transverse ligament, giving off numerous branches to the ligament. The medial part of the transverse ligament presents a thick rounded structure, surrounded by loose connective tissue. The fibres are arranged irregularly in bundles running horizontally on a tortuous course and with single spindle-like cells with darkly stained nuclei. The cells are not found at the ends of the ligament. Numerous blood vessels are observed between the bundles of fibres and on the periphery of the ligament.

  3. Transverse stability in a Stark decelerator

    SciTech Connect

    Meerakker, Sebastiaan Y. T. van de; Bethlem, Hendrick L.; Vanhaecke, Nicolas; Meijer, Gerard

    2006-02-15

    The concept of phase stability in a Stark decelerator ensures that polar molecules can be accelerated, guided, or decelerated without loss; molecules within a certain position and velocity interval are kept together throughout the deceleration process. In this paper the influence of the transverse motion on phase stability in a Stark decelerator is investigated. For typical deceleration experiments--i.e., for high values of the phase angle {phi}{sub 0}--the transverse motion considerably enhances the region in phase space for which phase stable deceleration occurs. For low values of {phi}{sub 0}, however, the transverse motion reduces the acceptance of a Stark decelerator and unstable regions in phase space appear. These effects are quantitatively explained in terms of a coupling between the longitudinal and transverse motion. The predicted longitudinal acceptance of a Stark decelerator is verified by measurements on a beam of OH (X {sup 2}{pi}{sub 3/2},J=3/2) radicals passing through a Stark decelerator.

  4. Maximum Possible Transverse Velocity in Special Relativity.

    ERIC Educational Resources Information Center

    Medhekar, Sarang

    1991-01-01

    Using a physical picture, an expression for the maximum possible transverse velocity and orientation required for that by a linear emitter in special theory of relativity has been derived. A differential calculus method is also used to derive the expression. (Author/KR)

  5. Measuring transverse shape with virtual photons

    SciTech Connect

    Hoyer, Paul; Kurki, Samu

    2011-06-01

    A two-dimensional Fourier transform of hadron form factors allows to determine their charge density in transverse space. We show that this method can be applied to any virtual photon induced transition, such as {gamma}{sup *}(q)+N{yields}{pi}N. Only Fock states that are common to the initial and final states contribute to the amplitudes, which are determined by the overlap of the corresponding light-front wave functions. Their transverse extent may be studied as a function of the final state configuration, allowing qualitatively new insight into strong interaction dynamics. Fourier transforming the cross section (rather than the amplitude) gives the distribution of the transverse distance between the virtual photon interaction vertices in the scattering amplitude and its complex conjugate. While the measurement of parton distributions in longitudinal momentum depends on the leading twist approximation (-q{sup 2}{yields}{infinity} limit), all q{sup 2}<0 values contribute to the Fourier transform, with the transverse resolution increasing with the available range in q{sup 2}. We illustrate the method using QED amplitudes.

  6. Sex Education as a Transversal Subject

    ERIC Educational Resources Information Center

    Rabelo, Amanda Oliveira; Pereira, Graziela Raupp; Reis, Maria Amélia; Ferreira, António G.

    2015-01-01

    Currently, sex education is in many countries a transversal subject, in which the school becomes a privileged place for the implementation of policies that aim at promoting "public health." Its design as a cross-cutting subject envisages fostering the dissemination of these subjects in all pedagogical and curricular fields; however, we…

  7. Transformation of 1H-benzotriazole by ozone in aqueous solution.

    PubMed

    Mawhinney, Douglas B; Vanderford, Brett J; Snyder, Shane A

    2012-07-01

    Recent studies have shown that 1H-benzotriazole is a widespread contaminant of wastewater and surface water. Although disinfection by ozone has been shown to efficiently remove this compound, the transformation products have not been identified. To that end, the reaction of ozone with 1H-benzotriazole in aqueous solution has been studied in real time employing quadrupole time-of-flight mass spectrometry (Q-TOF MS) and negative electrospray ionization. The transformation products have been identified by calculating their empirical formulas using accurate mass measurements, and further confirmed by performing the reaction with stable isotope-labeled 1H-benzotriazole and measuring product ion spectra. Stable reaction products were distinguished from transient species by plotting their extracted mass profiles. The products that resulted from ozone and hydroxyl radicals in the reaction were qualitatively identified by modifying the conditions to either promote the formation of hydroxyl radicals, or to scavenge them. Based on experimental evidence, a mechanism for the direct reaction between ozone and 1H-benzotriazole is proposed that results in the formation of 1H-1,2,3-triazole-4,5-dicarbaldehyde, which has an empirical formula of C(4)H(3)O(2)N(3). Lastly, it was confirmed that the same transformation products formed in surface water and tertiary-treated wastewater, although they were observed to degrade at higher ozone doses.

  8. Synthesis and preliminary evaluation of 3-thiocyanato-1H-indoles as potential anticancer agents.

    PubMed

    Fortes, Margiani P; da Silva, Paulo B N; da Silva, Teresinha G; Kaufman, Teodoro S; Militão, Gardenia C G; Silveira, Claudio C

    2016-08-01

    A novel series of twenty 3-thiocyanato-1H-indoles, carrying diversification at positions N-1, C-2 and C-5 of the heterocyclic core, were synthesized; their antiproliferative activity against four human cancer cell lines (HL60, HEP-2, NCI-H292 and MCF-7) was evaluated, employing doxorubicin as positive control. Indole, N-methylindole and 2-(4-chlorophenyl)-N-methylindole demonstrated to be essentially inactive, whereas several of their congener 3-thiocyanato-1H-indoles displayed good to excellent levels of potency (IC50 ≤ 6 μM), while being non-hemolytic. N-Phenyl-3-thiocyanato-1H-indole and 1-methyl-2-(4-chlorophenyl)-3-thiocyanato-1H-indole showed good to high potency against all the cell lines. On the other side, the N-(4-chlorophenyl)-, 2-(4-chlorophenyl)- and 2-phenyl- 3-thiocyanato-1H-indole derivatives were slightly less active against the test cell lines. Overall, these results suggest that the indole-3-thiocyanate motif can be suitably decorated to afford highly cytotoxic compounds and that the substituted indole can be employed as a useful scaffold toward more potent compounds.

  9. Urinary metabolic fingerprint of acute intermittent porphyria analyzed by (1)H NMR spectroscopy.

    PubMed

    Carichon, Mickael; Pallet, Nicolas; Schmitt, Caroline; Lefebvre, Thibaud; Gouya, Laurent; Talbi, Neila; Deybach, Jean Charles; Beaune, Philippe; Vasos, Paul; Puy, Hervé; Bertho, Gildas

    2014-02-18

    (1)H NMR is a nonbiased technique for the quantification of small molecules that could result in the identification and characterization of potential biomarkers with prognostic value and contribute to better understand pathophysiology of diseases. In this study, we used (1)H NMR spectroscopy to analyze the urinary metabolome of patients with acute intermittent porphyria (AIP), an inherited metabolic disorder of heme biosynthesis in which an accumulation of the heme precursors 5-aminolaevulinic acid (ALA) and porphobilinogen (PBG) promotes sudden neurovisceral attacks, which can be life-threatening. Our objectives were (1) to demonstrate the usefulness of (1)H NMR to identify and quantify ALA and PBG in urines from AIP patients and (2) to identify metabolites that would predict the response to AIP crisis treatment and reflect differential metabolic reprogramming. Our results indicate that (1)H NMR can help to diagnose AIP attacks based on the identification of ALA and PBG. We also show that glycin concentration increases in urines from patients with frequent recurrences at the end of the treatment, after an initial decrease, whereas PBG concentration remains low. Although the reasons for this altered are elusive, these findings indicate that a glycin metabolic reprogramming occurs in AIPr patients and is associated with recurrence. Our results validate the proof of concept of the usefulness of (1)H NMR spectroscopy in clinical chemistry for the diagnosis of acute attack of AIP and identify urinary glycin as a potential marker of recurrence of AIP acute attacks. PMID:24437734

  10. A disc wind interpretation of the strong Fe Kα features in 1H 0707-495

    NASA Astrophysics Data System (ADS)

    Hagino, Kouichi; Odaka, Hirokazu; Done, Chris; Tomaru, Ryota; Watanabe, Shin; Takahashi, Tadayuki

    2016-10-01

    1H 0707-495 is the most convincing example of a supermassive black hole with an X-ray spectrum being dominated by extremely smeared, relativistic reflection, with the additional requirement of strongly supersolar iron abundance. However, here we show that the iron features in its 2-10 keV spectrum are rather similar to the archetypal wind dominated source, PDS 456. We fit all the 2-10 keV spectra from 1H 0707-495 using the same wind model as used for PDS 456, but viewed at higher inclination so that the iron absorption line is broader but not so blueshifted. This gives a good overall fit to the data from 1H 0707-495, and an extrapolation of this model to higher energies also gives a good match to the NuSTAR data. Small remaining residuals indicate that the iron line emission is stronger than in PDS 456. This is consistent with the wider angle wind expected from a continuum-driven wind from the super-Eddington mass accretion rate in 1H 0707-495, and/or the presence of residual reflection from the underlying disc though the presence of the absorption line in the model removes the requirement for highly relativistic smearing, and highly supersolar iron abundance. We suggest that the spectrum of 1H 0707-495 is sculpted more by absorption in a wind than by extreme relativistic effects in strong gravity.

  11. Inhibition of monoamine oxidase by 3,4-dihydro-2(1H)-quinolinone derivatives.

    PubMed

    Meiring, Letitia; Petzer, Jacobus P; Petzer, Anél

    2013-10-15

    In the present study, a series of 3,4-dihydro-2(1H)-quinolinone derivatives were synthesized and evaluated as inhibitors of recombinant human monoamine oxidase (MAO) A and B. The 3,4-dihydro-2(1H)-quinolinone derivatives are structurally related to a series of coumarin (1-benzopyran-2-one) derivatives which have been reported to act as MAO-B inhibitors. The results document that the quinolinones are highly potent and selective MAO-B inhibitors with most homologues exhibiting IC50 values in the nanomolar range. The most potent MAO-B inhibitor, 7-(3-bromobenzyloxy)-3,4-dihydro-2(1H)-quinolinone, exhibits an IC50 value of 2.9 nM with a 2750-fold selectivity for MAO-B over the MAO-A isoform. An analysis of the structure-activity relationships for MAO-B inhibition shows that substitution on the C7 position of the 3,4-dihydro-2(1H)-quinolinone scaffold leads to significantly more potent inhibition compared to substitution on C6. In this regard, a benzyloxy substituent on C7 is more favourable than phenylethoxy and phenylpropoxy substitution on this position. It may be concluded that C7-substituted 3,4-dihydro-2(1H)-quinolinones are promising leads for the therapy of Parkinson's disease.

  12. The structure and properties of 5,6-dinitro-1H-benzotriazole

    NASA Astrophysics Data System (ADS)

    Santa María, Dolores; Claramunt, Rosa M.; Torralba, M. Carmen; Torres, M. Rosario; Alkorta, Ibon; Elguero, José

    2016-06-01

    5,6-Dinitro-1H-benzotriazole crystallizes in the monoclinic system, space group P21/c. The asymmetric unit contains the planar 1H-tautomer together with a water molecule of crystallization. Each water molecule is hydrogen bonded to three adjacent 5,6-dinitrobenzotriazoles forming a tape along the b-axis of the crystal. These tapes stack along the c-axis through hydrogen bonds involving the water molecules and one of the nitro groups leading to a bidimensional structure. Solid-state 13C and 15N CPMAS NMR allow to confirm that the tautomer present is the 1H one. In DMSO-d6 solution the results are quite different and, based on GIAO/B3LYP/6-311++G(d,p) calculations, lead us to conclude that the major tautomer is the 5,6-dinitro-2H-benzotriazole, a surprising result that contradicts the rule that the major tautomer in solution coincides with the one present in the crystal. An anhydrous pseudopolymorph of 5,6-dinitro-1H-benzotriazole has been obtained as a non-crystalline form and from solid-state NMR and theoretical calculations, we conclude that it is an 1H-tautomer.

  13. Protease-activated receptor-1 (PAR1) and PAR2 but not PAR4 mediate relaxations in lower esophageal sphincter.

    PubMed

    Huang, Shih-Che

    2007-07-01

    Protease-activated receptor-1 (PAR1), PAR2 and PAR4 activation can alter the gastrointestinal motility. To investigate effects mediated by PARs in the lower esophageal sphincter, we measured contraction or relaxation of transverse strips from the guinea-pig lower esophageal sphincter caused by PAR1 (TFLLR-NH2 and SFLLRN-NH2), PAR2 (SLIGKV-NH2 and SLIGRL-NH2) and PAR4 peptide agonists (GYPGKF-NH2, GYPGQV-NH2 and AYPGKF-NH2) as well as PAR protease activators (thrombin and trypsin). In resting lower esophageal sphincter strips, TFLLR-NH2 and SFLLRN-NH2 caused moderate concentration-dependent relaxation whereas thrombin did not cause any relaxation or contraction. Furthermore, in carbachol-contracted strips, TFLLR-NH2 and SFLLRN-NH2 caused marked whereas thrombin caused mild concentration-dependent relaxation. These indicate the existence of PAR1 mediating relaxation. Similarly, in resting lower esophageal sphincter strips, trypsin caused moderate concentration-dependent relaxation whereas SLIGRL-NH2 and SLIGKV-NH2 did not cause any relaxation or contraction. In addition, in carbachol-contracted strips, trypsin caused marked whereas SLIGRL-NH2 and SLIGKV-NH2 caused mild concentration-dependent relaxation. These indicate the existence of PAR2 mediating relaxation. The relaxant response of thrombin, TFLLR-NH2, trypsin and SLIGKV-NH2 was insensitive to atropine or tetrodotoxin, suggesting a direct effect. The relaxant response of trypsin was not affected by apamin, charybdotoxin, indomethacin and capsaicin but was attenuated by NG-nitro-L-arginine methyl ester, indicating involvement of NO. FSLLR-NH2, a PAR1 control peptide, and VKGILS-NH2, a PAR2 control peptide, as well as all three PAR4 peptide agonists, GYPGKF-NH2, GYPGQV-NH2 and AYPGKF-NH2, did not cause any relaxation or contraction. Taken together, these results demonstrate that PAR1 and PAR2 but not PAR4 mediate relaxations in the guinea-pig lower esophageal sphincter. PMID:17335921

  14. One-step detection of pathogens and viruses: combining magnetic relaxation switching and magnetic separation.

    PubMed

    Chen, Yiping; Xianyu, Yunlei; Wang, Yu; Zhang, Xiaoqing; Cha, Ruitao; Sun, Jiashu; Jiang, Xingyu

    2015-03-24

    We report a sensing methodology that combines magnetic separation (MS) and magnetic relaxation switching (MS-MRS) for one-step detection of bacteria and viruses with high sensitivity and reproducibility. We first employ a magnetic field of 0.01 T to separate the magnetic beads of large size (250 nm in diameter) from those of small size (30 nm in diameter) and use the transverse relaxation time (T2) of the water molecules around the 30 nm magnetic beads (MB30) as the signal readout of the immunoassay. An MS-MRS sensor integrates target enrichment, extraction, and detection into one step, and the entire immunoassay can be completed within 30 min. Compared with a traditional MRS sensor, an MS-MRS sensor shows enhanced sensitivity, better reproducibility, and convenient operation, thus providing a promising platform for point-of-care testing.

  15. A (15)N CPMG relaxation dispersion experiment more resistant to resonance offset and pulse imperfection.

    PubMed

    Jiang, Bin; Yu, Binhan; Zhang, Xu; Liu, Maili; Yang, Daiwen

    2015-08-01

    Carr-Purcell-Meiboom-Gill (CPMG) relaxation dispersion is a powerful NMR method to study protein dynamics on the microsecond-millisecond time scale. J-coupling, resonance offset, radio frequency field inhomogeneity, and pulse imperfection often introduce systematic errors into the measured transverse relaxation rates. Here we proposed a modified continuous wave decoupling CPMG experiment, which is more unaffected by resonance offset and pulse imperfection. We found that it is unnecessary to match the decoupling field strength with the delay between CPMG refocusing pulses, provided that decoupling field is strong enough. The performance of the scheme proposed here was shown by simulations and further demonstrated experimentally on a fatty acid binding protein. PMID:26037134

  16. Magnetic properties, water proton relaxivities, and in-vivo MR images of paramagnetic nanoparticles

    NASA Astrophysics Data System (ADS)

    Lee, Gang Ho; Chang, Yongmin

    2015-07-01

    In this mini review, magnetic resonance imaging (MRI) contrast agents based on lanthanideoxide (Ln2O3) nanoparticles are described. Ln2O3 (Ln = Gd, Dy, Ho, and Er) nanoparticles are paramagnetic, but show appreciable magnetic moments at room temperature and even at ultrasmall particle diameters. Among Ln2O3 nanoparticles, Gd2O3 nanoparticles show larger longitudinal water proton relaxivity (r1) values than Gd-chelates because of the large amount of Gd in the nanoparticle, and the other Ln2O3 nanoparticles (Ln = Dy, Ho, and Er) show appreciable transverse water proton relaxivity (r2) values. Therefore, Gd2O3 nanoparticles are potential T1 MRI contrast agents while the other Ln2O3 nanoparticles are potential T2 MRI contrast agents at high MR fields.

  17. The generalized Phillips-Twomey method for NMR relaxation time inversion

    NASA Astrophysics Data System (ADS)

    Gao, Yang; Xiao, Lizhi; Zhang, Yi; Xie, Qingming

    2016-10-01

    The inversion of NMR relaxation time involves the Fredholm integral equation of the first kind. Due to its ill-posedness, numerical solutions to this type of equations are often found much less accurate and bear little resemblance to the true solution. There has been a strong interest in finding a well-posed method for this ill-posed problem since 1950s. In this paper, we prove the existence, the uniqueness, the stability and the convergence of the generalized Phillips-Twomey regularization method for solving this type of equations. Numerical simulations and core analyses arising from NMR transverse relaxation time inversion are conducted to show the effectiveness of the generalized Phillips-Twomey method. Both the simulation results and the core analyses agree well with the model and the realities.

  18. Measurement of Young's relaxation modulus using nanoindentation

    NASA Astrophysics Data System (ADS)

    Huang, Gang; Lu, Hongbing

    2006-09-01

    In a previous paper (Lu et al., Mechanics of Time-Dependent Materials, 7, 2003, 189 207), we described methods to measure the creep compliance of polymers using Berkovich and spherical indenters by nanoindentation. However, the relaxation modulus is often needed in stress and deformation analysis. It has been well known that the interconversion between creep compliance and relaxation function presents an ill-posed problem, so that converting the creep compliance function to the relaxation function cannot always give accurate results, especially considering that the creep data at short times in nanoindentation are often not reliable, and the overall nanoindentation time is short, typically a few hundred seconds. In this paper, we present methods to measure Young’s relaxation functions directly using nanoindentation. A constant-rate displacement loading history is usually used in nanoindentations. Using viscoelastic contact mechanics, Young’s relaxation modulus is extracted using nanoindentation load-displacement data. Three bulk polymers, Polymethyl Methacrylate (PMMA), Polycarbonate (PC) and Polyurethane (PU), are used in this study. The Young’s relaxation functions measured from the nanoindentation are compared with data measured from conventional tensile and shear tests to evaluate the precision of the methods. A reasonably good agreement has been reached for all these materials for indentation depth higher than a certain value, providing reassurance for these methods for measuring relaxation functions.

  19. Mineralogical controls on NMR rock surface relaxivity: A case study of the Fontainebleau Sandstone

    NASA Astrophysics Data System (ADS)

    Livo, Kurt

    Pore size distribution is derived from nuclear magnetic resonance, but is scaled by surface relaxivity. While nuclear magnetic resonance studies generally focus on the difficulty of determining pore size distribution in unconventional shale reservoirs, there is a lack of discussion concerning pure quartz sandstones. Long surface relaxivity causes complications analyzing nuclear magnetic resonance data for pore size distribution determination. Currently, I am unaware of research that addresses the complicated pore size distribution determination in long relaxing, pure sandstone formations, which is essential to accurate downhole petrophysical modeling. The Fontainebleau sandstone is well known for its homogenous mineralogical makeup and wide range of porosity and permeability. The Hibernia sandstone exhibits a similar mineralogy and is characterized by a similar and porosity-permeability range to the Fontainebleau sandstones, but with a significantly higher portion of clay minerals (1-6%). I present systematic petrophysical properties such as porosity, pore size distribution from nuclear magnetic resonance transverse relaxation times, permeability, and volumetric magnetic susceptibility to aide in characterization of the Fontainebleau sandstone. Analysis of collected nuclear magnetic resonance data is then compared to other petrophysical studies from literature such as helium porosity and permeability, magnetic susceptibility, and electrical conductivity. I find that the lack of impurities on the grain surfaces of pure quartz samples imparts a lower surface relaxivity as compared to clay containing sandstones and makes nuclear magnetic resonance analysis more complex. Thus, inverted nuclear magnetic resonance data from cleaner outcrop samples incorrectly models pore size distribution without accounting for wider surface relaxivity variation and is improperly used when characterizing the Fontainebleau sandstone. This is further supported by evidence from less

  20. Heteronuclear Adiabatic Relaxation Dispersion (HARD) for quantitative analysis of conformational dynamics in proteins

    NASA Astrophysics Data System (ADS)

    Traaseth, Nathaniel J.; Chao, Fa-An; Masterson, Larry R.; Mangia, Silvia; Garwood, Michael; Michaeli, Shalom; Seelig, Burckhard; Veglia, Gianluigi

    2012-06-01

    NMR relaxation methods probe biomolecular motions over a wide range of timescales. In particular, the rotating frame spin-lock R1ρ and Carr-Purcell-Meiboom-Gill (CPMG) R2 experiments are commonly used to characterize μs to ms dynamics, which play a critical role in enzyme folding and catalysis. In an effort to complement these approaches, we introduced the Heteronuclear Adiabatic Relaxation Dispersion (HARD) method, where dispersion in rotating frame relaxation rate constants (longitudinal R1ρ and transverse R2ρ) is created by modulating the shape and duration of adiabatic full passage (AFP) pulses. Previously, we showed the ability of the HARD method to detect chemical exchange dynamics in the fast exchange regime (kex ˜ 104-105 s-1). In this article, we show the sensitivity of the HARD method to slower exchange processes by measuring R1ρ and R2ρ relaxation rates for two soluble proteins (ubiquitin and 10C RNA ligase). One advantage of the HARD method is its nominal dependence on the applied radio frequency field, which can be leveraged to modulate the dispersion in the relaxation rate constants. In addition, we also include product operator simulations to define the dynamic range of adiabatic R1ρ and R2ρ that is valid under all exchange regimes. We conclude from both experimental observations and simulations that this method is complementary to CPMG-based and rotating frame spin-lock R1ρ experiments to probe conformational exchange dynamics for biomolecules. Finally, this approach is germane to several NMR-active nuclei, where relaxation rates are frequency-offset independent.

  1. Dynamics-based selective 2D {sup 1}H/{sup 1}H chemical shift correlation spectroscopy under ultrafast MAS conditions

    SciTech Connect

    Zhang, Rongchun; Ramamoorthy, Ayyalusamy

    2015-05-28

    Dynamics plays important roles in determining the physical, chemical, and functional properties of a variety of chemical and biological materials. However, a material (such as a polymer) generally has mobile and rigid regions in order to have high strength and toughness at the same time. Therefore, it is difficult to measure the role of mobile phase without being affected by the rigid components. Herein, we propose a highly sensitive solid-state NMR approach that utilizes a dipolar-coupling based filter (composed of 12 equally spaced 90° RF pulses) to selectively measure the correlation of {sup 1}H chemical shifts from the mobile regions of a material. It is interesting to find that the rotor-synchronized dipolar filter strength decreases with increasing inter-pulse delay between the 90° pulses, whereas the dipolar filter strength increases with increasing inter-pulse delay under static conditions. In this study, we also demonstrate the unique advantages of proton-detection under ultrafast magic-angle-spinning conditions to enhance the spectral resolution and sensitivity for studies on small molecules as well as multi-phase polymers. Our results further demonstrate the use of finite-pulse radio-frequency driven recoupling pulse sequence to efficiently recouple weak proton-proton dipolar couplings in the dynamic regions of a molecule and to facilitate the fast acquisition of {sup 1}H/{sup 1}H correlation spectrum compared to the traditional 2D NOESY (Nuclear Overhauser effect spectroscopy) experiment. We believe that the proposed approach is beneficial to study mobile components in multi-phase systems, such as block copolymers, polymer blends, nanocomposites, heterogeneous amyloid mixture of oligomers and fibers, and other materials.

  2. Tracking Temperature-Dependent Relaxation Times of Ferritin Nanomagnets with a Wideband Quantum Spectrometer

    NASA Astrophysics Data System (ADS)

    Schäfer-Nolte, Eike; Schlipf, Lukas; Ternes, Markus; Reinhard, Friedemann; Kern, Klaus; Wrachtrup, Jörg

    2014-11-01

    We demonstrate the tracking of the spin dynamics of ensemble and individual magnetic ferritin proteins from cryogenic up to room temperature using the nitrogen-vacancy color center in diamond as a magnetic sensor. We employ different detection protocols to probe the influence of the ferritin nanomagnets on the longitudinal and transverse relaxation of the nitrogen-vacancy center, which enables magnetic sensing over a wide frequency range from Hz to GHz. The temperature dependence of the observed spectral features can be well understood by the thermally induced magnetization reversals of the ferritin and enables the determination of the anisotropy barrier of single ferritin molecules.

  3. Diffusion effects on the CPMG relaxation rate in a dipolar field.

    PubMed

    Ziener, C H; Kampf, T; Jakob, P M; Bauer, W R

    2010-01-01

    The diffusion in the magnetic dipolar field around a sphere is considered. The diffusion is restricted to the space between two concentric spheres, where the inner sphere is the source of the magnetic dipolar field. Analytical expressions for the CPMG transverse relaxation rate as well as the free induction decay and the spin echo time evolution are given in the Gaussian approximation. The influence of the inter-echo time is analyzed. The limiting cases of small and large inter-echo times as well as the short and long time behavior are evaluated.

  4. A physiological and subjective evaluation of meditation, hypnosis, and relaxation.

    PubMed

    Morse, D R; Martin, J S; Furst, M L; Dubin, L L

    1977-01-01

    Ss were monitored for respiratory rate, pulse rate, blood pressure, skin resistance, EEG activity, and muscle activity. They were monitored during the alert state, meditation (TM or simple word type), hypnosis (relaxation and task types), and relaxation. Ss gave a verbal comparative evaluation of each state. The results showed significantly better relaxation responses for the relaxation states (relaxation, relaxation-hypnosis, meditation) than for the alert state. There were no significant differences between the relaxation states except for the measure "muscle activity" in which meditation was significantly better than the other relaxation states. Overall, there were significant differences between task-hypnosis and relaxation-hypnosis. No significant differences were found between TM and simple word meditation. For the subjective measures, relaxation-hypnosis and meditation were significantly better than relaxation, but no significant differences were found between meditation and relaxation-hypnosis.

  5. NMR permeability estimators in `chalk' carbonate rocks obtained under different relaxation times and MICP size scalings

    NASA Astrophysics Data System (ADS)

    Rios, Edmilson Helton; Figueiredo, Irineu; Moss, Adam Keith; Pritchard, Timothy Neil; Glassborow, Brent Anthony; Domingues, Ana Beatriz Guedes; Azeredo, Rodrigo Bagueira de Vasconcellos

    2016-07-01

    The effect of the selection of different nuclear magnetic resonance (NMR) relaxation times for permeability estimation is investigated for a set of fully brine-saturated rocks acquired from Cretaceous carbonate reservoirs in the North Sea and Middle East. Estimators that are obtained from the relaxation times based on the Pythagorean means are compared with estimators that are obtained from the relaxation times based on the concept of a cumulative saturation cut-off. Select portions of the longitudinal (T1) and transverse (T2) relaxation-time distributions are systematically evaluated by applying various cut-offs, analogous to the Winland-Pittman approach for mercury injection capillary pressure (MICP) curves. Finally, different approaches to matching the NMR and MICP distributions using different mean-based scaling factors are validated based on the performance of the related size-scaled estimators. The good results that were obtained demonstrate possible alternatives to the commonly adopted logarithmic mean estimator and reinforce the importance of NMR-MICP integration to improving carbonate permeability estimates.

  6. NMR permeability estimators in 'chalk' carbonate rocks obtained under different relaxation times and MICP size scalings

    NASA Astrophysics Data System (ADS)

    Rios, Edmilson Helton; Figueiredo, Irineu; Moss, Adam Keith; Pritchard, Timothy Neil; Glassborow, Brent Anthony; Guedes Domingues, Ana Beatriz; Bagueira de Vasconcellos Azeredo, Rodrigo

    2016-07-01

    The effect of the selection of different nuclear magnetic resonance (NMR) relaxation times for permeability estimation is investigated for a set of fully brine-saturated rocks acquired from Cretaceous carbonate reservoirs in the North Sea and Middle East. Estimators that are obtained from the relaxation times based on the Pythagorean means are compared with estimators that are obtained from the relaxation times based on the concept of a cumulative saturation cut-off. Select portions of the longitudinal (T1) and transverse (T2) relaxation-time distributions are systematically evaluated by applying various cut-offs, analogous to the Winland-Pittman approach for mercury injection capillary pressure (MICP) curves. Finally, different approaches to matching the NMR and MICP distributions using different mean-based scaling factors are validated based on the performance of the related size-scaled estimators. The good results that were obtained demonstrate possible alternatives to the commonly adopted logarithmic mean estimator and reinforce the importance of NMR-MICP integration to improving carbonate permeability estimates.

  7. Spin dynamics simulation of electron spin relaxation in Ni{sup 2+}(aq)

    SciTech Connect

    Rantaharju, Jyrki Mareš, Jiří Vaara, Juha

    2014-07-07

    The ability to quantitatively predict and analyze the rate of electron spin relaxation of open-shell systems is important for electron paramagnetic resonance and paramagnetic nuclear magnetic resonance spectroscopies. We present a combined molecular dynamics (MD), quantum chemistry (QC), and spin dynamics simulation method for calculating such spin relaxation rates. The method is based on the sampling of a MD trajectory by QC calculations, to produce instantaneous parameters of the spin Hamiltonian used, in turn, to numerically solve the Liouville-von Neumann equation for the time evolution of the spin density matrix. We demonstrate the approach by simulating the relaxation of electron spin in an aqueous solution of Ni{sup 2+} ion. The spin-lattice (T{sub 1}) and spin-spin (T{sub 2}) relaxation rates are extracted directly from the simulations of the time dependence of the longitudinal and transverse magnetization, respectively. Good agreement with the available, indirectly obtained experimental data is obtained by our method.

  8. Low-field one-dimensional and direction-dependent relaxation imaging of bovine articular cartilage

    NASA Astrophysics Data System (ADS)

    Rössler, Erik; Mattea, Carlos; Mollova, Ayret; Stapf, Siegfried

    2011-12-01

    The structure of articular cartilage is separated into three layers of differently oriented collagen fibers, which is accompanied by a gradient of increasing glycosaminoglycan (GAG) and decreasing water concentration from the top layer towards the bone interface. The combined effect of these structural variations results in a change of the longitudinal and transverse relaxation times as a function of the distance from the cartilage surface. In this paper, this dependence is investigated at a magnetic field strength of 0.27 T with a one-dimensional depth resolution of 50 μm on bovine hip and stifle joint articular cartilage. By employing this method, advantage is taken of the increasing contrast of the longitudinal relaxation rate found at lower magnetic field strengths. Furthermore, evidence for an orientational dependence of relaxation times with respect to an axis normal to the surface plane is given, an observation that has recently been reported using high-field MRI and that was explained by preferential orientations of collagen bundles in each of the three cartilage zones. In order to quantify the extent of a further contrast mechanism and to estimate spatially dependent glycosaminoglycan concentrations, the data are supplemented by proton relaxation times that were acquired in bovine articular cartilage that was soaked in a 0.8 mM aqueous Gd ++ solution.

  9. The Stern-Gerlach experiment and the effects of spin relaxation.

    PubMed

    Wennerström, Håkan; Westlund, Per-Olof

    2012-02-01

    The classical Stern-Gerlach experiment is analyzed with an emphasis on the spin dynamics. The central question asked is whether there occurs a relaxation of the spin angular momentum during the time the particle passes through the Stern-Gerlach magnet. We examine in particular the transverse relaxation, involving angular momentum exchange between the spin of the particles and the spins of the magnet. A method is presented describing relaxation effects at an individual particle level. This leads to a stochastic equation of motion for the spins. This is coupled to a classical equation of motion for the particle translation. The experimental situation is then modeled through simulations of individual trajectories using two sets of parameter choices and three different sets of initial conditions. The two main conclusions are: (A) if the coupling between the magnet and the spin is solely described by the Zeeman interaction with the average magnetic field the simulations show a clear disagreement with the experimental observation of Stern and Gerlach. (B) If one, on the other hand, also allows for a T(2) relaxation time shorter than the passage time one can obtain a practically quantitative agreement with the experimental observations. These conclusions are at variance with the standard textbook explanation of the Stern-Gerlach experiment.

  10. Relaxation of vibrational degrees of freedom

    NASA Astrophysics Data System (ADS)

    Frohn, A.

    Shock tubes were used to measure relaxation times of the degrees of freedom in inelastic collisions of gas molecules. Design and construction of the experimental setup are described. For relaxation time measurements of vibrational degrees of freedom an initial pressure between 0.1 and 1 mbar is found to be optimal, and for dissociation between 1 and 10 mbar. The density gradients in the shock tube flow are measured with four differential laser interferometers and plotted with a transient recorder. A FORTRAN program was developed to determine the relaxation times. This measurement technique does not in general allow the degrees of freedom to be investigated separately.

  11. Relaxation time in disordered molecular systems

    SciTech Connect

    Rocha, Rodrigo P.; Freire, José A.

    2015-05-28

    Relaxation time is the typical time it takes for a closed physical system to attain thermal equilibrium. The equilibrium is brought about by the action of a thermal reservoir inducing changes in the system micro-states. The relaxation time is intuitively expected to increase with system disorder. We derive a simple analytical expression for this dependence in the context of electronic equilibration in an amorphous molecular system model. We find that the disorder dramatically enhances the relaxation time but does not affect its independence of the nature of the initial state.

  12. Collisionless Relaxation in Non-Neutral Plasmas

    SciTech Connect

    Levin, Yan; Pakter, Renato; Teles, Tarcisio N.

    2008-02-01

    A theoretical framework is presented which allows us to quantitatively predict the final stationary state achieved by a non-neutral plasma during a process of collisionless relaxation. As a specific application, the theory is used to study relaxation of charged-particle beams. It is shown that a fully matched beam relaxes to the Lynden-Bell distribution. However, when a mismatch is present and the beam oscillates, parametric resonances lead to a core-halo phase separation. The approach developed accounts for both the density and the velocity distributions in the final stationary state.

  13. Le Chatelier's principle with multiple relaxation channels

    NASA Astrophysics Data System (ADS)

    Gilmore, R.; Levine, R. D.

    1986-05-01

    Le Chatelier's principle is discussed within the constrained variational approach to thermodynamics. The formulation is general enough to encompass systems not in thermal (or chemical) equilibrium. Particular attention is given to systems with multiple constraints which can be relaxed. The moderation of the initial perturbation increases as additional constraints are removed. This result is studied in particular when the (coupled) relaxation channels have widely different time scales. A series of inequalities is derived which describes the successive moderation as each successive relaxation channel opens up. These inequalities are interpreted within the metric-geometry representation of thermodynamics.

  14. Requirements for muscle relaxation in Friedreich's ataxia.

    PubMed

    Mouloudi, H; Katsanoulas, C; Frantzeskos, G

    1998-02-01

    Friedreich's ataxia is an inherited disorder of the nervous system, requiring special care during anaesthesia, because of increased sensitivity to muscle relaxants. We report a case of Friedreich's ataxia in a 31-year-old woman, anaesthetised on two occasions, for tendinoplasty and pes cavus repair. Atracurium was used for neuromuscular blockade and monitored by a train-of-four twitch technique. The patient's response was normal. She returned to adequate spontaneous breathing within 20 min of the last dose of the muscle relaxant without need for anticholinesterase administration. When neuromuscular function is monitored, normal doses of muscle relaxant can safely be used in these patients.

  15. Amino­silanes derived from 1H-benzimidazole-2(3H)-thione

    PubMed Central

    Palomo-Molina, Juliana; García-Báez, Efrén V.; Contreras, Rosalinda; Pineda-Urbina, Kayim; Ramos-Organillo, Angel

    2015-01-01

    Two new mol­ecular structures, namely 1,3-bis­(tri­methyl­silyl)-1H-benzimidazole-2(3H)-thione, C13H22N2SSi2, (2), and 1-tri­methyl­silyl-1H-benzimidazole-2(3H)-thione, C10H14N2SSi, (3), are reported. Both systems were derived from 1H-benzimidazole-2(3H)-thione. Noncovalent C—H⋯π inter­actions between the centroid of the benzmidazole system and the SiMe3 groups form helicoidal arrangements in (2). Dimerization of (3) results in the formation of R 2 2(8) rings via N—H⋯S inter­actions, along with parallel π–π inter­actions between imidazole and benzene rings. PMID:26322611

  16. Contiguously substituted cyclooctane polyols. configurational assignments via (1)H NMR correlations and symmetry considerations.

    PubMed

    Moura-Letts, Gustavo; Paquette, Leo A

    2008-10-01

    More advanced oxidation of the cyclooctadienol shown, readily available in enantiomerically pure form from D-glucose, has given rise to a series of intermediates whose relative (and ultimately absolute) configuration was assigned on the basis of (1)H/(1)H coupling constant analysis. The selectivities that were deduced in this manner were drawn from the sequential application of CrO3 oxidation in tandem with Luche reduction, two-step NMO-promoted osmylations bracketed by acetonide formation, and wholesale deprotection. The stereoselectivities of these reactions were traced by (1)H NMR spectroscopy, and the stereochemical assignments were confirmed by the presence or absence of symmetry in the final cyclooctane polyols (four shown) generated in this investigation.

  17. Protein-induced water 1H MR frequency shifts: Contributions from magnetic susceptibility and exchange effects

    NASA Astrophysics Data System (ADS)

    Luo, Jie; He, Xiang; d'Avignon, D. Andre'; Ackerman, Joseph J. H.; Yablonskiy, Dmitriy A.

    2010-01-01

    Defining the biophysics underlying the remarkable MRI phase contrast reported in high field MRI studies of human brain would lead to more quantitative image analysis and more informed pulse sequence development. Toward this end, the dependence of water 1H resonance frequency on protein concentration was investigated using bovine serum albumin (BSA) as a model system. Two distinct mechanisms were found to underlie a water 1H resonance frequency shift: (i) a protein-concentration-induced change in bulk magnetic susceptibility, causing a shift to lower frequency, and (ii) exchange of water between chemical-shift distinct environments, i.e., free (bulk water) and protein-associated ("bound") water, including freely exchangeable 1H sites on proteins, causing a shift to higher frequency. At 37 °C the amplitude of the exchange effect is roughly half that of the susceptibility effect.

  18. Congenital Cataracts and Gut Dysmotility in a DYNC1H1 Dyneinopathy Patient

    PubMed Central

    Gelineau-Morel, Rose; Lukacs, Marshall; Weaver, K. Nicole; Hufnagel, Robert B.; Gilbert, Donald L.; Stottmann, Rolf W.

    2016-01-01

    Whole exome sequencing continues to end the diagnostic odyssey for a number of patients and expands our knowledge of phenotypes associated with gene mutations. We describe an 11-year-old female patient with a constellation of symptoms including congenital cataracts, gut dysmotility, sensory neuropathy, and bifrontal polymicrogyria. Whole exome sequencing was performed and identified a de novo heterozygous missense mutation in the ATPase motor domain of cytoplasmic dynein heavy chain 1 (DYNC1H1), which is known to be involved in neuronal migration and retrograde axonal transport. The mutation was found to be highly damaging by multiple prediction programs. The residue is highly conserved, and reported mutations in this gene result in a variety of phenotypes similar to that of our patient. We report only the second case of congenital cataracts and the first of gut dysmotility in a patient with DYNC1H1, thus expanding the spectrum of disease seen in DYNC1H1 dyneinopathies. PMID:27754416

  19. 17O-Decoupled 1H Spectroscopy and Imaging with a Surface Coil: STEAM Decoupling

    NASA Astrophysics Data System (ADS)

    Charagundla, Sridhar R.; Duvvuri, Umamaheswar; Noyszewski, Elizabeth A.; Dandora, Rahul; Stolpen, Alan H.; Leigh, J. S.; Reddy, Ravinder

    2000-03-01

    17O-decoupled 1H spin-echo imaging has been reported as a means of indirect 17O detection, with potential application to measurement of blood flow and metabolism. In its current form, 17O decoupling requires large RF amplitudes and a 180° refocusing pulse, complicating its application in volume and surface coils, respectively. To overcome this problem, we have developed an 17O-decoupled proton stimulated echo sequence ("STEAM decoupling") to allow 17O detection with a surface coil. A high B1 amplitude is easily generated, allowing complete decoupling of 17O and 1H. Slice-selective, 17O-decoupled 1H imaging is readily performed and the sequence is easily adapted for localized spectroscopy. Intrinsic correction for variations in B1 and further compensation for B1 inhomogeneity are discussed.

  20. Synthesis, characterization and theoretical studies of 5-(benzylthio)-1-cylopentyl-1H-tetrazole.

    PubMed

    Saglam, S; Disli, A; Erdogdu, Y; Marchewka, M K; Kanagathara, N; Bay, B; Güllüoğlu, M T

    2015-01-25

    In this study, 5-(benzylthio)-1-cylopentyl-1H-tetrazole (5B1C1HT) have been synthesized. Boiling points of the obtained compound have been determined and it has been characterized by FT-IR, (1)H NMR, (13)C-APT and LC-MS spectroscopy techniques. The FT-IR, (1)H NMR and (13)C-APT spectral measurements of the 5B1C1HT compound and complete assignment of the vibrational bands observed in spectra has been discussed. The spectra were interpreted with the aid of normal coordinate analysis following full structure optimization and force field calculations based on Density Functional Theory (DFT) at 6-311++G(**), cc-pVDZ and cc-pVTZ basis sets. The optimized geometry with 6-311++G(**) basis sets were used to determine the total energy distribution, harmonic vibrational frequencies, IR intensities. PMID:25171051

  1. Aminosilanes derived from 1H-benzimidazole-2(3H)-thione.

    PubMed

    Palomo-Molina, Juliana; García-Báez, Efrén V; Contreras, Rosalinda; Pineda-Urbina, Kayim; Ramos-Organillo, Angel

    2015-09-01

    Two new molecular structures, namely 1,3-bis(trimethylsilyl)-1H-benzimidazole-2(3H)-thione, C13H22N2SSi2, (2), and 1-trimethylsilyl-1H-benzimidazole-2(3H)-thione, C10H14N2SSi, (3), are reported. Both systems were derived from 1H-benzimidazole-2(3H)-thione. Noncovalent C-H···π interactions between the centroid of the benzmidazole system and the SiMe3 groups form helicoidal arrangements in (2). Dimerization of (3) results in the formation of R2(2)(8) rings via N-H···S interactions, along with parallel π-π interactions between imidazole and benzene rings.

  2. Analysis of micro-structural relaxation phenomena in laser-modified fused silica using confocal Raman microscopy

    SciTech Connect

    Matthews, M; Vignes, R; Cooke, J; Yang, S; Stolken, J

    2009-12-15

    Fused silica micro-structural changes associated with localized 10.6 {micro}m CO{sub 2} laser heating are reported. Spatially-resolved shifts in the high-frequency asymmetric stretch transverse-optic (TO) phonon mode of SiO{sub 2} were measured using confocal Raman microscopy, allowing construction of axial fictive temperature (T{sub f}) maps for various laser heating conditions. A Fourier conduction-based finite element model was employed to compute on-axis temperature-time histories, and, in conjunction with a Tool-Narayanaswamy form for structural relaxation, used to fit T{sub f}(z) profiles to extract relaxation parameters. Good agreement between the calculated and measured T{sub f} was found, yielding reasonable values for relaxation time and activation enthalpy in the laser-modified silica.

  3. Dependence of the time of the appearance of a Stark echo response on irreversible relaxation of a system

    NASA Astrophysics Data System (ADS)

    Akhmedshina, E. N.; Nefed'ev, L. A.; Garnaeva, G. I.

    2016-09-01

    The dependence of the time of the appearance of a Stark (gradient) echo response on the irreversible transverse relaxation time of a system in the nanosecond range and on the width of the excitation region of an inhomogeneously broadened line has been investigated. It has been shown that the use of nonresonant laser pulses with an artificially created spatial inhomogeneity makes it possible to determine the relaxation time in the nanosecond range from the time of the appearance of a Stark (gradient) echo response, which is a more accurate method than the method of determining the relaxation time from the decay of the intensity by varying time intervals of the exposure to inhomogeneous electromagnetic fields.

  4. 40 CFR 721.1750 - 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium salts. 721.1750 Section 721.1750... 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium...-tyl-oxy)-, sodium salt (PMN P-92-35), and 1H-benzotriazole, 5-(pentyloxy)- , potassium salt (PMN...

  5. 40 CFR 721.1750 - 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium salts. 721.1750 Section 721.1750... 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium...-tyl-oxy)-, sodium salt (PMN P-92-35), and 1H-benzotriazole, 5-(pentyloxy)- , potassium salt (PMN...

  6. 40 CFR 721.1750 - 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium salts. 721.1750 Section 721.1750... 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium...-tyl-oxy)-, sodium salt (PMN P-92-35), and 1H-benzotriazole, 5-(pentyloxy)- , potassium salt (PMN...

  7. 40 CFR 721.1750 - 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium salts. 721.1750 Section 721.1750... 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium...-tyl-oxy)-, sodium salt (PMN P-92-35), and 1H-benzotriazole, 5-(pentyloxy)- , potassium salt (PMN...

  8. 40 CFR 721.1750 - 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium salts. 721.1750 Section 721.1750... 1H-Benzotriazole, 5-(pen-tyl-oxy)- and 1H-ben-zo-tri-a-zole, 5-(pen-tyl-oxy)-, sodium and potassium...-tyl-oxy)-, sodium salt (PMN P-92-35), and 1H-benzotriazole, 5-(pentyloxy)- , potassium salt (PMN...

  9. {sup 1}H NMR study of hydrogen in quasicrystalline Ti{sub 0.45{minus}x}V{sub x}Zr{sub 0.38}Ni{sub 0.17}

    SciTech Connect

    Shastri, A.; Majzoub, E.H.; Borsa, F.; Gibbons, P.C.; Kelton, K.F.

    1998-03-01

    {sup 1}H nuclear-magnetic-resonance (NMR) spectra and spin-lattice relaxation rates (R{sub 1}) were studied in the hydrogenated Ti{sub 0.45{minus}x}V{sub x}Zr{sub 0.38}Ni{sub 0.17} quasicrystal for x=0.00, 0.02, and a hydrogen-to-metal-atom ratio (H/M)=1.88. NMR measurements were made from 4 to 550 K at resonance frequencies of 8, 18, 55, and 200 MHz. Theoretical {sup 1}H second-moment values (M{sub 2}) were calculated based on Bergman and Mackay cluster models and compared with experimental M{sub 2} values. The R{sub 1} data reveal a distribution of activation energies for the {sup 1}H diffusion through the quasilattice; the distribution is insensitive to the vanadium concentration, x. Low-temperature R{sub 1} data reveal an additional low-temperature relaxation mechanism that is not yet well understood. {copyright} {ital 1998} {ital The American Physical Society}

  10. Relativistic Force Field: Parametrization of (13)C-(1)H Nuclear Spin-Spin Coupling Constants.

    PubMed

    Kutateladze, Andrei G; Mukhina, Olga A

    2015-11-01

    Previously, we reported a reliable DU8 method for natural bond orbital (NBO)-aided parametric scaling of Fermi contacts to achieve fast and accurate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR. As sophisticated NMR experiments for precise measurements of carbon-proton SSCCs are becoming more user-friendly and broadly utilized by the organic chemistry community to guide and inform the process of structure determination of complex organic compounds, we have now developed a fast and accurate method for computing (13)C-(1)H SSCCs. Fermi contacts computed with the DU8 basis set are scaled using selected NBO parameters in conjunction with empirical scaling coefficients. The method is optimized for inexpensive B3LYP/6-31G(d) geometries. The parametric scaling is based on a carefully selected training set of 274 ((3)J), 193 ((2)J), and 143 ((1)J) experimental (13)C-(1)H spin-spin coupling constants reported in the literature. The DU8 basis set, optimized for computing Fermi contacts, which by design had evolved from optimization of a collection of inexpensive 3-21G*, 4-21G, and 6-31G(d) bases, offers very short computational (wall) times even for relatively large organic molecules containing 15-20 carbon atoms. The most informative SSCCs for structure determination, i.e., (3)J, were computed with an accuracy of 0.41 Hz (rmsd). The new unified approach for computing (1)H-(1)H and (13)C-(1)H SSCCs is termed "DU8c".

  11. Relativistic Force Field: Parametrization of (13)C-(1)H Nuclear Spin-Spin Coupling Constants.

    PubMed

    Kutateladze, Andrei G; Mukhina, Olga A

    2015-11-01

    Previously, we reported a reliable DU8 method for natural bond orbital (NBO)-aided parametric scaling of Fermi contacts to achieve fast and accurate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR. As sophisticated NMR experiments for precise measurements of carbon-proton SSCCs are becoming more user-friendly and broadly utilized by the organic chemistry community to guide and inform the process of structure determination of complex organic compounds, we have now developed a fast and accurate method for computing (13)C-(1)H SSCCs. Fermi contacts computed with the DU8 basis set are scaled using selected NBO parameters in conjunction with empirical scaling coefficients. The method is optimized for inexpensive B3LYP/6-31G(d) geometries. The parametric scaling is based on a carefully selected training set of 274 ((3)J), 193 ((2)J), and 143 ((1)J) experimental (13)C-(1)H spin-spin coupling constants reported in the literature. The DU8 basis set, optimized for computing Fermi contacts, which by design had evolved from optimization of a collection of inexpensive 3-21G*, 4-21G, and 6-31G(d) bases, offers very short computational (wall) times even for relatively large organic molecules containing 15-20 carbon atoms. The most informative SSCCs for structure determination, i.e., (3)J, were computed with an accuracy of 0.41 Hz (rmsd). The new unified approach for computing (1)H-(1)H and (13)C-(1)H SSCCs is termed "DU8c". PMID:26414291

  12. 1H stray-field long spin-echo trains and MRI: novel studies on the photopolymerization of a commercial dental resin

    NASA Astrophysics Data System (ADS)

    Nunes, Teresa G.; Guillot, Geneviève; Pereira, Sónia G.; Pires, Ricardo

    2002-06-01

    Photopolymerization of a commercial dental resin has been investigated by 1H stray-field (STRAFI) magnetic resonance. The resin is a visible light-cured system, included in a new generation adhesive, which is used to bond the restorative material to enamel or dentin. Different methods were used to follow the curing reaction, which involve long and short spin-echo train acquisitions to obtain one-slice and one-dimensional data, respectively. The echo attenuation, in the limit of very short time delays, could be described as the sum of two exponentials. While the intensity of the early echoes in the train appeared mainly governed by spin-spin relaxation, the decay of the last echoes seemed to depend also on spin-lattice relaxation in the rotating frame. The relative amplitude of the long-time component was found to decrease from 84% to 10% with the photopolymerization progress, and a STRAFI degree of conversion of 74% could thus be suggested. The influence of the curing protocol was observed in STRAFI profiles.

  13. Investigation of Proton Dynamics in a (CH3)4 NCdCl3 Single Crystal by using 1H Nuclear Magnetic Resonance Measurements

    NASA Astrophysics Data System (ADS)

    Lee, Moohee; Sim, Jung Seok; Kang, Kihyeok; Hyoun Kim, Ho; Kim, Ae Ran

    2013-03-01

    (CH3)4 NCdCl3(TMCC) is reported to exhibit two first-order structural phase transitions. The crystal has a hexagonal structure in phase I at room temperature and then changes to a monoclinic one in phase II below 118 K. Finally a ferro-elastic monoclinic phase III appears below 104 K. The a- and c-axes of TMMC were found by using X-ray diffraction at room temperature. 1H NMR measurements of spectrum, spin-lattice relaxation time T1 and rotating-frame relaxation time T1ρ were performed at 4.8 T parallel or perpendicular to the c-axis from 300 K down to 65 K. The spectrum shows no significant changes at both transition temperatures. T1 and T1ρ monotonically decrease at low temperature and then show an abrupt decrease around 110 K. As the temperature decreases further, T1 shows a minimum at 100 K and becomes longer whereas T1ρ continuously decreases. From these data, the proton dynamical behavior is analyzed and identified.

  14. Synthesis of 1H-indole-2,3-dione-3-thiosemicarbazone ribonucleosides as antibacterial agents.

    PubMed

    Kassab, Shaymaa E; Hegazy, Gehan H; Eid, Nahed M; Amin, Kamelia M; El-Gendy, Adel A

    2010-01-01

    A new isatin ribonucleoside (3) was synthesized in a good yield by trimethylsilyl trifluoromethanesulfonate (TMSOTf) catalyzed coupling reaction between the silylated nitrogenated base of 1H-Indole-2,3-dione (1) and 1,2,3,5-tetra-O-acetyl-beta-D-ribfuranose (2). Thiosemicarbazides 4a-e were utilized by the prepared ribonucleoside (3) to give new series of 1H-indole-2,3-dione-3-thiosemicarbazone ribonucleosides 5a-e. All compounds tested as antibacterial agents showed slight inhibitory activity against the selected bacterial strains.

  15. Fruit juice authentication by 1H NMR spectroscopy in combination with different chemometrics tools.

    PubMed

    Cuny, M; Vigneau, E; Le Gall, G; Colquhoun, I; Lees, M; Rutledge, D N

    2008-01-01

    To discriminate orange juice from grapefruit juice in a context of fraud prevention, (1)H NMR data were submitted to different treatments to extract informative variables which were then analysed using multivariate techniques. Averaging contiguous data points of the spectrum followed by logarithmic transformation improved the results of the data analysis. Moreover, supervised variable selection methods gave better rates of classification of the juices into the correct groups. Last, independent-component analysis gave better classification results than principal-component analysis. Hence, ICA may be an efficient chemometric tool to detect differences in the (1)H NMR spectra of similar samples, and so may be useful for authentication of foods.

  16. 1H and 13C NMR assignments for the cyanine dyes SYBR Safe and thiazole orange.

    PubMed

    Evenson, William E; Boden, Lauren M; Muzikar, Katy A; O'Leary, Daniel J

    2012-12-01

    Analysis of (1)H and (13)C NMR and mass spectral data for the fluorescent nucleic acid stain SYBR Safe indicates that it contains a cyanine-based cationic core structure identical to thiazole orange. The difference between these two compounds is the type of N-substitution on the quinolinium ring system (SYBR Safe, n-Pr; thiazole orange, Me). The (1)H and (13)C NMR resonances for both compounds were assigned on the basis of one- and two-dimensional (COSY, ROESY, HSQC, and HMBC) experiments. The preferred conformation of these compounds was computed by ab initio methods and found to be consistent with the NMR data.

  17. The (1) H NMR spectrum of pyrazole in a nematic phase.

    PubMed

    Provasi, Patricio; Jimeno, María Luisa; Alkorta, Ibon; Reviriego, Felipe; Elguero, José; Jokisaari, Jukka

    2016-08-01

    The experimental (1) H nuclear magnetic resonance (NMR) spectrum of 1H-pyrazole was recorded in thermotropic nematic liquid crystal N-(p-ethoxybenzylidene)-p-butylaniline (EBBA) within the temperature range of 299-308 K. Two of three observable dipolar DHH -couplings appeared to be equal at each temperature because of fast prototropic tautomerism. Analysis of the Saupe orientational order parameters using fixed geometry determined by computations and experimental dipolar couplings results in a situation in which the molecular orientation relative to the magnetic field (and the liquid crystal director) can be described exceptionally by a single parameter. Copyright © 2016 John Wiley & Sons, Ltd.

  18. Detection of hydrogen dissolved in acrylonitrile butadiene rubber by 1H nuclear magnetic resonance

    NASA Astrophysics Data System (ADS)

    Nishimura, Shin; Fujiwara, Hirotada

    2012-01-01

    Rubber materials, which are used for hydrogen gas seal, can dissolve hydrogen during exposure in high-pressure hydrogen gas. Dissolved hydrogen molecules were detected by solid state 1H NMR of the unfilled vulcanized acrylonitrile butadiene rubber. Two signals were observed at 4.5 ppm and 4.8 ppm, which were assignable to dissolved hydrogen, in the 1H NMR spectrum of NBR after being exposed 100 MPa hydrogen gas for 24 h at room temperature. These signals were shifted from that of gaseous hydrogen molecules. Assignment of the signals was confirmed by quantitative estimation of dissolved hydrogen and peak area of the signals.

  19. Transverse spin and momentum in structured light: quantum spin Hall effect and transverse optical force

    NASA Astrophysics Data System (ADS)

    Bliokh, Konstantin Y.

    2016-03-01

    We provide an overview of recent theoretical and experimental studies, which revisited the basic dynamical properties of light: momentum and angular momentum. Recently, we described qualitatively new types of the spin and momentum in structured optical fields. These are: (i) the transverse spin, which is orthogonal to the wave vector and is independent of the helicity, and (ii) the anomalous transverse momentum, which depends on the helicity of light. Both of these quantities were described and measured experimentally in various optical systems, and they are currently attracting rapidly growing attention. In particular, the transverse spin in evanescent waves has found promising applications for robust spin-controlled unidirectional coupling to surface and waveguide optical modes. In turn, the transverse momentum provides a weak spin-dependent optical force, which is orthogonal to both the propagation direction and the intensity gradient in a wave field.

  20. Transversity and Transverse-Momentum Distribution Measurements from Phenix and Brahms

    NASA Astrophysics Data System (ADS)

    Aidala, C.

    2009-04-01

    A variety of measurements performed utilizing transversely polarized proton-proton collisions at the Relativistic Heavy Ion Collider (RHIC) are now available. Recent results from the PHENIX and BRAHMS experiments are presented and discussed.