Search results for "Magnetism"

showing 10 items of 1934 documents

Determining Factors for the Unfolding Pathway of Peptides, Peptoids, and Peptidic Foldamers.

2016

We present a study of the mechanical unfolding pathway of five different oligomers (α-peptide, β-peptide, δ-aromatic-peptides, α/γ-peptides, and β-peptoids), adopting stable helix conformations. Using force-probe molecular dynamics, we identify the determining structural factors for the unfolding pathways and reveal the interplay between the hydrogen bond strength and the backbone rigidity in the stabilization of their helix conformations. On the basis of their behavior, we classify the oligomers in four groups and deduce a set of rules for the prediction of the unfolding pathways of small foldamers.

010405 organic chemistryStereochemistryHydrogen bondChemistry010402 general chemistry01 natural sciences0104 chemical sciencesSurfaces Coatings and FilmsMolecular dynamicsCrystallographyRigidity (electromagnetism)HelixMaterials ChemistryPhysical and Theoretical ChemistryThe journal of physical chemistry. B
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Nonanuclear Spin-Crossover Complex Containing Iron(II) and Iron(III) Based on a 2,6-Bis(pyrazol-1-yl)pyridine Ligand Functionalized with a Carboxylat…

2016

The synthesis and magnetostructural characterization of [Fe(III)3(μ3-O)(H2O)3[Fe(II)(bppCOOH)(bppCOO)]6](ClO4)13·(CH3)2CO)6·(solvate) (2) are reported. This compound is obtained as a secondary product during synthesis of the mononuclear complex [Fe(II)(bppCOOH)2](ClO4)2 (1). The single-crystal X-ray diffraction structure of 2 shows that it contains the nonanuclear cluster of the formula [Fe(III)3(μ3-O)(H2O)3[Fe(II)(bppCOOH)(bppCOO)]6](13+), which is formed by a central Fe(III)3O core coordinated to six partially deprotonated [Fe(II)(bppCOOH)(bppCOO)](+) complexes. Raman spectroscopy studies on single crystals of 1 and 2 have been performed to elucidate the spin and oxidation states of iron …

010405 organic chemistryStereochemistryTrimer010402 general chemistry01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundsymbols.namesakeCrystallographyDeprotonationchemistrySpin crossoverCluster (physics)symbolsAntiferromagnetismCarboxylatePhysical and Theoretical ChemistrySpin (physics)Raman spectroscopyInorganic chemistry
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Application of Rigidity-Controlled Supramolecular Affinity Materials for the Gravimetric Detection of Hazardous and Illicit Compounds.

2016

The combination of an (-)-isosteviol-derived building block and 9,9'-spirobifluorene or tetraphenylmethane generated highly potent new affinity materials for the detection of volatile organic compounds (VOCs). Comparison of their affinity behaviour with different core structures showed remarkable influence on selectivity and sensitivity due to structural rigidity and their pre-organization. Their unique supramolecular properties were investigated in an affinity assay using high fundamental frequency quartz crystal microbalances.

010405 organic chemistrySupramolecular chemistryGeneral Chemistry010402 general chemistry01 natural sciences0104 chemical scienceschemistry.chemical_compoundRigidity (electromagnetism)Molecular recognitionchemistryOrganic chemistryGravimetric analysisSelectivityStructural rigidityTetraphenylmethaneChemPlusChem
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New, Multi‐Dimensional Cu(tn)‐[M(CN) 6 ] n – Cyano‐Bridged, Bimetallic Coordination Materials (M = Fe II , Co III , Cr III and tn = 1,3‐Diaminopropan…

2005

Reaction of the [Fe I I I (CN) 6 ] 3 - anion with [Cu I I (tn)(H 2 O) n ] 2 + (tn = 1,3-diaminopropane) affords the compounds [{Cu I I (tn)} 2 -{Fe I I (CN) 6 }].KCl.5H 2 O (1), [(Cu"(tn))2(Fe"(CN) 6 )].4H 2 O (2), and [{Cu I I (tnH) 2 (H 2 O) 2 }{Fe I I (CN) 6 }].2H 2 O (3). Each iron center in 1 and 2 is linked to six copper(II) ions by six cyanide bridges, while each copper ion is linked to three equivalent iron(II) ions. Despite these resemblances, the two compounds present large structural differences caused by two different orientations of the Cu-NC-Fe bridges: compound 1 has a 2D structure which can be described as successions of "Cu 4 Fe 3 " defective cubane units, while compound 2 …

010405 organic chemistrychemistry.chemical_element13-DiaminopropaneBridging ligandProtonation010402 general chemistry01 natural sciencesCopper0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundParamagnetismCrystallographychemistryCubaneAntiferromagnetismBimetallic stripEuropean Journal of Inorganic Chemistry
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Synthesis, crystal structure and magnetic properties of the cyclic tetranuclear compound [Cu4(pz)4(hppa)2(H2O)4] [pz = pyrazolate; hppa = R,S-2-hydro…

2019

Abstract The synthesis, X-ray structure and magnetic properties of the neutral tetranuclear copper(II) complex of formula [Cu4(pz)4(hppa)2(H2O)4] (1) [Hpz = pyrazole and hppa = R,S-2-hydroxo-2-phenyl-2-(1-pyrazolyl)acetate] are reported. Remarkably, the structure of 1 reveals the presence of the S- and R-forms of the new hppa ligand which is formed in situ in the complex reaction between copper(II), pyrazole and phenylmalonate in water:methanol solvent mixture under ambient conditions. The two crystallographically independent copper(II) ions [Cu(1)/Cu(2)] are five-coordinate in square pyramidal surroundings. Three nitrogen atoms, from two pz groups and one hppa ligand and one oxygen atom of…

010405 organic chemistrychemistry.chemical_elementCrystal structurePyrazole010402 general chemistry01 natural sciencesMagnetic susceptibilityCopperSquare pyramidal molecular geometry0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryMaterials ChemistryAntiferromagnetismMoleculeCarboxylatePhysical and Theoretical ChemistryPolyhedron
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Controlled treatment of a high velocity anisotropic aquifer model contaminated by hexachlorocyclohexanes

2020

International audience; Xanthan gels were assessed to control the reductive dechlorination of hexachlorocyclohexanes (HCHs) and trichlorobenzenes (TCBs) in a strong permeability contrast and high velocity sedimentary aquifer. An alkaline degradation was selected because of the low cost of NaOH and Ca(OH)2. The rheology of alkaline xanthan gels and their ability to deliver alkalinity homogeneously, while maintaining the latter, were studied. Whereas the xanthan gels behaved like non-Newtonian shear-thinning fluids, alkalinity and Ca(OH)2 microparticles had detrimental effects, yet, the latter decreased with the shear-rate. Breakthrough curves for the NaOH and Ca(OH)2 in xanthan solutions, ca…

010504 meteorology & atmospheric sciencesWater flowHealth Toxicology and MutagenesisInorganic chemistryKineticsAlkalinityAlkalinityAquifer010501 environmental sciencesToxicology01 natural sciencesPermeabilityRheologyReductive dechlorinationmedicine[CHIM]Chemical SciencesGroundwaterXanthan gum0105 earth and related environmental sciencesgeographygeography.geographical_feature_categoryChemistryPolysaccharides BacterialAquifer remediationGeneral MedicinePollution6. Clean waterPermeability (electromagnetism)AnisotropyRheologyGelsHexachlorocyclohexaneXanthan gummedicine.drugEnvironmental Pollution
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Global-Scale Evaluation of Roughness Effects on C-Band AMSR-E Observations

2015

Quantifying roughness effects on ground surface emissivity is an important step in obtaining high-quality soil moisture products from large-scale passive microwave sensors. In this study, we used a semi-empirical method to evaluate roughness effects (parameterized here by the parameter) on a global scale from AMSR-E (Advanced Microwave Scanning Radiometer for EOS) observations. AMSR-E brightness temperatures at 6.9 GHz obtained from January 2009 to September 2011, together with estimations of soil moisture from the SMOS (Soil Moisture and Ocean Salinity) L3 products and of soil temperature from ECMWF’s (European Centre for Medium-range Weather Forecasting) were used as inputs in a retrieval…

010504 meteorology & atmospheric sciencestélédétectionScience0211 other engineering and technologiesWeather forecasting[SDU.STU]Sciences of the Universe [physics]/Earth SciencesElectromagnétismesoil surface roughness02 engineering and technologySurface finishcomputer.software_genredonnée satellite01 natural sciencesSciences de la TerreNormalized Difference Vegetation Indexsoil moisture;soil surface roughness;AMSR-EElectromagnetismEmissivitySurface roughnessTraitement du signal et de l'image14. Life underwaterWater content021101 geological & geomatics engineering0105 earth and related environmental sciencesRemote sensingRadiometercapteur smosQSignal and Image processingradiométrie microondesVegetationAMSR-E15. Life on land[SPI.ELEC]Engineering Sciences [physics]/ElectromagnetismEarth SciencesGeneral Earth and Planetary SciencesEnvironmental sciencesoil moisturecomputer[SPI.SIGNAL]Engineering Sciences [physics]/Signal and Image processingRemote Sensing
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Direct terrestrial–marine correlation demonstrates surprisingly late onset of the last interglacial in central Europe

2011

AbstractAn interdisciplinary study of a small sedimentary basin at Neumark Nord 2 (NN2), Germany, has yielded a high-resolution record of the palaeomagnetic Blake Event, which we are able to place at the early part of the last interglacial pollen sequence documented from the same section. We use this data to calculate the duration of this stratigraphically important event at 3400 ± 350 yr. More importantly, the Neumark Nord 2 data enables precise terrestrial–marine correlation for the Eemian stage in central Europe. This shows a remarkably large time lag of ca. 5000 yr between the MIS 5e ‘peak’ in the marine record and the start of the last interglacial in this region.

010506 paleontologyEemiangeographyPaleomagnetismgeography.geographical_feature_category010504 meteorology & atmospheric sciencesAardwetenschappenBlake EventMIS 5ePalaeomagnetismLast interglacialTime lagLate onsetEemianSedimentary basin01 natural sciencesSequence (geology)PaleontologyArts and Humanities (miscellaneous)InterglacialShort PaperGeneral Earth and Planetary SciencesGeology0105 earth and related environmental sciencesEarth-Surface ProcessesQuaternary Research
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A secondary mode of action of the herbicide lenacil: Modification of K+ permeability of Acer pseudoplatanus cells

1984

Abstract The action of lenacil on plasmalemma permeability to K+, transmembrane electric potential difference (PD) calculated from the tetraphenylphosphonium distribution, proton extrusion and intracellular pH of Acer pseudoplatanus cells calculated from the 5,5-dimethyloxazolidine,4-dione distribution, was studied and compared with the action of fusicoccin (FC) and diethylstilbestrol (DES). The three compounds temporarily stimulated the rate of 86Rb+ uptake with a half-maximum effect at 5.0 μM for 3-cyclohexyl-6, 7-dihdro-1H-cyclopentapyrimidine-2,4(3H,5H)-dione (lenacil). Lenacil and FC had no action on transmembrane electric potential difference, whereas DES decreased it. Lenacil inhibit…

0106 biological sciencesAbsorption (pharmacology)Stereochemistry[SDV]Life Sciences [q-bio]Intracellular pHKineticsSoil Science01 natural sciences03 medical and health scienceschemistry.chemical_compoundMode of actionComputingMilieux_MISCELLANEOUS030304 developmental biologyMembrane potential0303 health sciencesbiologyChemistryERABLE FAUX PLATANEAcer pseudoplatanusbiology.organism_classification[SDV] Life Sciences [q-bio]Permeability (electromagnetism)FusicoccinBiophysicsAgronomy and Crop Science010606 plant biology & botanyPlant Science Letters
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Giant, unconventional anomalous Hall effect in the metallic frustrated magnet candidate, KV 3 Sb 5

2020

The anomalous Hall effect soars when Dirac quasiparticles meet frustrated magnetism.

02 engineering and technology01 natural sciencesCondensed Matter::Materials ScienceHall effectCondensed Matter::Superconductivity0103 physical sciencesAstrophysics::Solar and Stellar Astrophysics010306 general physicsAstrophysics::Galaxy AstrophysicsResearch ArticlesPhysicsMultidisciplinaryCondensed matter physicsScatteringDirac (video compression format)PhysicsSciAdv r-articles021001 nanoscience & nanotechnologyCondensed Matter::Mesoscopic Systems and Quantum Hall EffectSemimetalFerromagnetismMagnetQuasiparticleSpin Hall effectCondensed Matter::Strongly Correlated Electrons0210 nano-technologyResearch ArticleScience Advances
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