Search results for "Spectra"

showing 10 items of 3542 documents

Structural and spectroscopic characterisation of 2-(2'-hydroxybenzoyl)pyrrole and its O-methyl derivative

2004

Abstract Density functional theory calculations on the tautomeric and conformational equilibria of 2-(2′-hydroxybenzoyl)pyrrole (HBP) and 2-(2′-methoxybenzoyl)pyrrole (MBP) were performed. Moreover, the experimental IR and UV spectra of the same compounds were recorded and compared with the theoretical data. The presence of an intramolecular hydrogen bond in HBP can be related to the biological activities of some of its derivatives.

Hydrogen bondMethyl derivativeCondensed Matter PhysicsBiochemistryTautomerSettore CHIM/08 - Chimica Farmaceuticachemistry.chemical_compoundUv spectrachemistryComputational chemistryIntramolecular forceDensity functional theoryPhysical and Theoretical ChemistryDFT calculations2-(2′-Hydroxybenzoyl)pyrrole2-(2′-Methoxybenzoyl)pyrrolePyrrole
researchProduct

Deuterium hyperfine splittings in the rotational spectrum of NH2D as revealed by Lamb-dip spectroscopy

2020

Abstract In the context of radio-astronomical observations, laboratory experiments constitute a cornerstone in the interpretation of rich line surveys due to the concomitant presence of numerous emitting molecules. Here, we report the investigation of three different rotational transitions of mono-deuterated ammonia (NH2D), a species of astrophysical interest, for which the contribution of the deuterium nuclear spin to the rotational spectrum has been resolved for the first time in the millimeter- and submillimeter-wave domain. The effect of hyperfine interactions on the rotational spectrum has been unveiled by a combined theoretical and experimental approach. Quantum-chemical calculations …

HydrogenQuantum-chemical calculationschemistry.chemical_elementContext (language use)010402 general chemistry01 natural sciencesSpectral lineDeuterium fractionationAmmoniaInterstellar medium0103 physical sciencesPhysical and Theoretical ChemistrySpectroscopyHyperfine structureSpectroscopyAstrophysics::Galaxy AstrophysicsLine (formation)Physics010304 chemical physicsSpectrometerAtomic and Molecular Physics and Optics0104 chemical sciencesDeuteriumchemistryHyperfine structureAtomic physicsLamb-dip technique
researchProduct

15N NMR: Substituent effect analysis inpara-andmeta-substituted phenylhydrazines

1994

15N NMR spectra of phenylhydrazine and of 14 para- and meta-substituted phenylhydrazines were measured at natural isotope abundance in DMSO-d6 solution. The substituent present exerts a larger influence on the chemical shift of the nitrogen atom directly bound to the aromatic ring (N-1) than on the second one (N-2), which shows an attenuated and inverted trend. The chemical shifts of N-1 and N-2 give a good cross correlation in both series of compounds if p-NO2 and m-F derivatives are excluded from the correlations of para- and meta-substituted phenylhydrazines, respectively. Moreover, N-1 SCS values show good linear correlations with Hammett substituent constants, with SCSs of directly bou…

HydrogenStereochemistryChemical shiftPhenylhydrazinesSubstituentchemistry.chemical_elementGeneral ChemistryRing (chemistry)Medicinal chemistryNMR spectra databasechemistry.chemical_compoundAnilinechemistryGeneral Materials SciencePhenylhydrazineMagnetic Resonance in Chemistry
researchProduct

Long-term X-ray variability of the microquasar system LS 5039/RX J1826.2−1450

2003

We report on the results of the spectral and timing analysis of a BeppoSAX observation of the microquasar system LS 5039/RX J1826.2-1450. The source was found in a low-flux state with Fx(1-10 keV)= 4.7 x 10^{-12} erg cm^{-2} s^{-1}, which represents almost one order of magnitude lower than a previous RXTE observation 2.5 years before. The 0.1--10 keV spectrum is described by an absorbed power-law continuum with photon-number spectral index Gamma=1.8+-0.2 and hydrogen column density of NH=1.0^{+0.4}_{-0.3} x 10^{22} cm^{-2}. According to the orbital parameters of the system the BeppoSAX observation covers the time of an X-ray eclipse should one occur. However, the 1.6-10 keV light curve does…

HydrogenVariable starschemistry.chemical_elementFOS: Physical sciencesAstrophysicsCompact starAstrophysicsUNESCO::ASTRONOMÍA Y ASTROFÍSICAAccretion rateRadio astronomyQuasarsQuàsarsEstels binaris de raigs XOrbital elementsPhysicsSpectral indexRX J1826.2−1450Astrophysics (astro-ph)X-rayIndividual Star ; LS 5039 ; RX J1826.2−1450 ; 3EG J1824−1514 – X-rays ; Variable stars ;; General–radio continuumAstronomy and AstrophysicsIndividual StarLight curveGeneral–radio continuum:ASTRONOMÍA Y ASTROFÍSICA::Cosmología y cosmogonia [UNESCO]StarsEstelsX-ray binarieschemistrySpace and Planetary ScienceRadioastronomiaLS 50393EG J1824−1514 – X-raysUNESCO::ASTRONOMÍA Y ASTROFÍSICA::Cosmología y cosmogoniaOrder of magnitude:ASTRONOMÍA Y ASTROFÍSICA [UNESCO]
researchProduct

Application of 61Ni Mössbauer spectroscopy to chemical problems

1996

Using the possibility to produce 61Co sources at the MAinz MIcrotron, 61Ni Mossbauer spectroscopy was applied to different kinds of chemical problems. Measurements of isomer shifts and V zz values in some common compounds and compounds with unusual chemical bonding for comparison with band structure calculations, measurement of 61Ni Mossbauer parameters in model compounds for hydrogenase and dehydrogenase with an active [NiS4] centre, and study of novel binary NiF3 compounds at helium temperature are presented.

HydrogenaseMaterials scienceNuclear magnetic resonanceChemical bondMössbauer spectroscopyGeneral Physics and AstronomyPhysical chemistryMossbauer spectraElectronic band structureMicrotronHelium temperatureIl Nuovo Cimento D
researchProduct

Estimation of Evapotranspiration by Hargreaves Formula and Remotely Sensed Data in Semi-arid Mediterranean Areas

1997

Abstract A methodology is proposed for estimating evapotranspiration by Hargreaves formula and image analysis of remotely sensed data. At first, for a large sicilian basin (Belice basin), theactualevapotranspiration values are estimated by the energy balance equation, spectral data of two Landsat TM images and ground agrometereological measurements. Then theseactualevapotranspiration estimates and thereferenceevapotranspiration values obtained by a slightly modified Hargreaves formula, which incorporates the outgoing short-wave radiation and an albedo coefficient equal to 0·23, are used for calculating suitable crop coefficients. Finally, the minimum area of each land-use map unit, obtained…

HydrologyCrop coefficientPixelComputer Science::Computer Vision and Pattern RecognitionEvapotranspirationEnergy balanceEnvironmental scienceAquatic ScienceStructural basinAlbedoAridMultispectral pattern recognitionRemote sensingJournal of Agricultural Engineering Research
researchProduct

Detecting crop water status in mature olive orchards using vegetation spectral measurements.

2014

Full spectral measurements (350–2500 nm) at tree canopy and leaf levels and the corresponding leaf water potentials (LWP) were acquired in an olive grove of Sicily, at different hours of the day, during summer season 2011. The main objective of the work was to assess, on the basis of the experimental data-set, two different approaches to detect crop water status in terms of LWP. Specifically, using existing families of Vegetation Indices (VIs) and applying Partial Least Squares Regression (PLSR) were optimised and tested. The results indicated that a satisfactory estimation of LWP at tree canopy and leaf levels can be obtained using vegetation indices based on the near infrared–shortwave in…

HydrologyLeaf Water PotentialTree canopySpectral indexMean squared errorMoistureSoil ScienceCrop Water StatuVegetationCropSpectroradiometerControl and Systems EngineeringPartial least squares regressionSettore AGR/08 - Idraulica Agraria E Sistemazioni Idraulico-ForestaliLeaf water potential; Olive tree; Field SpectroscopyAgronomy and Crop ScienceOlive treeSpectroscopyField SpectroscopyFood ScienceRemote sensingMathematics
researchProduct

Vegetation cover seasonal changes assessment from TM imagery in a semi-arid landscape

2004

This work evaluates the suitability of spectral mixture analysis (SMA) methods to assess vegetation cover seasonal changes in a desertification context. Our main interest is to produce remotely sensed derived maps, sensitive to vegetation activity and quite independent of the soil background. A further aim is to analyse the inter-annual variations of this magnitude for different natural vegetation species, in response to seasonal and climatic changes. Fractional vegetation cover (FVC) was obtained using a Variable Endmember Spectral Mixture Analysis (VESMA) technique. The aim is to identify the main vegetation cover and lithological units and decompose them in separate stages. The use of sp…

HydrologySpectral signaturemedia_common.quotation_subjectContext (language use)VegetationEnhanced vegetation indexAridNormalized Difference Vegetation IndexDesertificationGeneral Earth and Planetary SciencesPlant coverEnvironmental sciencePhysical geographymedia_commonInternational Journal of Remote Sensing
researchProduct

Recent results on mesonic weak decay of Λ-hypernuclei

2010

The FINUDA experiment has performed a systematic study of mesonic weak decay of p-shell Λ-hypernuclei. Recent results on the mesonic decay spectra and ratios are illustrated and discussed.

Hypernuclei; mesonic weak decayPhysicsNuclear and High Energy PhysicsFINUDANuclear TheoryLambda-hypernucleiΛ-hypernucleiGeneral Physics and AstronomyLambda-hypernuclei; mesonic decay; spin assignmentAstrophysicsMesonic decayLambdaSpectral lineNuclear physicsSpin assignmentmesonic weak decayΛ-hypernuclei; Mesonic decay; Spin assignmentHypernucleiHigh Energy Physics::ExperimentNuclear Experiment
researchProduct

Strong thermal nonequilibrium in hypersonic CO and CH4 probed by CRDS

2015

A new experimental setup coupling a High Enthalpy Source (HES) reaching 2000 K to a cw-cavity ring-down spectrometer has been developed to investigate rotationally cold hot bands of polyatomic molecules in the [1.5, 1.7] μm region. The rotational and vibrational molecular degrees of freedom are strongly decoupled in the hypersonic expansion produced by the HES and probed by cavity ring-down spectroscopy. Carbon monoxide has been used as a first test molecule to validate the experimental approach. Its expansion in argon led to rotational and vibrational temperatures of 6.7 ± 0.8 K and 2006 ± 476 K, respectively. The tetradecad polyad of methane (1.67 μm) was investigated under similar condit…

Hypersonic speedMaterials scienceEnthalpyGeneral Physics and AstronomyInfrared spectroscopychemistry.chemical_elementNon-equilibrium thermodynamics01 natural sciencesMolecular physicsSpectral line0103 physical sciencesThermalCompounds of carbonPhysical and Theoretical ChemistrySpectroscopy010303 astronomy & astrophysicsComputingMilieux_MISCELLANEOUSchemistry.chemical_classification[PHYS]Physics [physics]Argon[ PHYS ] Physics [physics]010304 chemical physicsPolyatomic ionchemistryExcited stateAtomic physics
researchProduct