Thermodynamic parameters derived from NMR data
Thermodynamic Absorption Parameters of Disazo Dyes derived from P-aminophenol and 4-Aminobenzoic Acid on Polyester Fibre and Nylon 6 Fibre
... Nine tightly closed test-tubes were placed in a thermostated dyebath-set at 363 K and 373 K respectively. Ten milliliters of dye liquor was placed in each test-tube to give 10 percent shade with a liquor ratio 80:1. ...
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Thermodynamic parameters of bonds in glassy materials from viscosity-temperature relationships
... viscosity data these enthalpy and entropy terms can be ...viscosity data for a number of glassy materials including SiO 2 , GeO 2 , B 2 O 3 , anorthite, diopside, xNa 2 O-(1 – x)SiO 2 , xPbO-(1 – x)SiO 2 , ...
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Cloud and Thermodynamic Parameters Retrieved from Satellite Ultraspectral Infrared Measurements
... ultraspectral data; no other data from satellite or surface-based instruments nor from numerical weather analysis/prediction models is utilized in assisting or constraining the retrieval ...
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Prediction of NMR parameters in the solid-state
... cluster derived from the -quartz structure, both using the GIPAW approach with NCP and with the IGAIM approach with a large pentuple zeta Gaussian ...
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Molecular Mechanism for the Hofmeister Effect Derived from NMR and DSC Measurements on Barnase
... excluded from a protein ’ s apolar surfaces, but the molecular mechanism of the e ff ect has been ...excluded from the protein surface, more that they have a lower free energy when they do not interact ...
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Soil Consolidation Parameters Derived from CPTu Probing
... information from different depths. To have a better density of data and statistical possibility, then higher amount of laboratory samples is ...convenient from economy of survey ...
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Automated protein structure calculation from NMR data
... of NMR structures. Since NMR structures comprise some 15% of the Protein Data Bank, and a rather higher fraction of protein folds (Spronk et ...be derived from automated methods is that ...
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Physical and thermodynamic data
... Traditionally the parameter salinity, S, has been used to give a measure of the total dissolved solids in sea water. Originally this was intended to be an analytical parameter with the units g·kg –1 , but this direct ...
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Temperature dependence of NMR parameters calculated from path integral molecular dynamics simulations.
... obtained from the PIMD simulations were significantly broader than for the classical-nucleus ...temperatures. NMR parameters obtained from PIMD probability distributions are, therefore, less ...
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Effect of Thermodynamic Parameters on the Concentration of Pollutants in Produced Water from Crude Oil Production
... water from crude oil production to meet the limits acceptable for disposal by the ...quality data on the concentrations of the pollutants in the produced water were used for simulation but some quality ...
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H NMR, 13 C NMR and mass spectral data. The
... 2,5-disubstituted-[1,3,4]-oxadaiazoles derived from 2- (aryloxymethyl)benzoic acids have been successfully synthesized in 60-70% yields and are characterized by 1 H NMR, 13 C NMR, Mass ...
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Elastic properties, thermal stability, and thermodynamic parameters of MoAlB
... experimental data nicely with c p values quite near the mean of the three DSC measurements, the range of which are shown as error bars in ...find from the least-squares fitting ...amounts from 0 to ...
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Excess Thermodynamic Parameters of Binary Liquid Mixtures at 303K
... 303K. From the measured data, related acoustical and thermodynamic excess parameters such as, the excess adiabatic compressibility(β ...
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A theoretical study on the thermodynamic parameters for some imidazolium crystals
... a thermodynamic calculations of mechanical, electronic and chemical bonding in 1,3-diisopropyl-4, 5- dimethylimidazolium cyano-1-phenylthenolate (1), 1,3-diisopropyl-4,5-dimethylimidazolium-2-nitrodiethylmalonate ...
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CALCULATION AND ANALYSIS OF THERMODYNAMIC PARAMETERS OF Di-SUBSTITUTED PYRIDINE
... in thermodynamic functions appear to be one of most important application of vibrational spectra of the complex ...molecules. From the vibrational data obtained from the spectra, Urey [14], ...
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Handling of uncertainty in thermodynamic data
... input parameters (thermodynamic database, water composition, ...changes from Am(CO 3 ) 2 Na·5H 2 O for pH 7 to Am 2 (CO 3 ) 3 for pH 6, while the solubility is increased by ...
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NUMERICAL METHOD FOR UNCERTAINTY ASSESSMENT OF THE TOPOGRAPHIC PARAMETERS DERIVED FROM DEMS
... spatial data bases related to presentation of terrain features and ...of data structure is especially suitable for morphometric terrain evaluation and analysis which is very important in modeling Earth ...
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Theoretical study via DFT for prediction of 13C and 1H NMR data of two diterpenoids derived from the root of Salvia grandifolia (Short communication)
... traditional NMR experimental techniques, comparing experimental data with theoretical data, thereby achieving accurate and satisfactory ...experimental data of two diterpenes were compared to ...
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Morphometric study on knee parameters values derived from magnetic resonance imaging scan data of patients with knee injuries
... knee parameters values of knee joint among the Malaysian ...benefit from the findings of present study in the evaluation of PCL structure before reconstruction ...
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Experimental, Thermodynamic and Kinetic Studies for the Adsorption of Phenolic Compounds Derived from Oilfield Wastewater by the Corncob Hydrochar
... pared from the hydrothermal carbonization of corncob as an adsorbent for phenols in aqueous ...time. Thermodynamic analysis shows that the adsorption process is endo- thermic and spontaneous in ...
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