Search results for "Proton"
showing 10 items of 5886 documents
Controlled Activation of Substrate Templating in Molecular Self-Assembly by Deprotonation
2013
cited By 7; International audience; Templated assembly of organic molecules constitutes a promising approach for fabricating functional nanostructures at surfaces with molecular-scale control. Using the substrate template for steering the adsorbate growth enables creating a rich variety of molecular structures by tuning the subtle balance of intermolecular and molecule–surface interactions. On insulating surfaces, however, surface templating is largely absent due to the comparatively weak molecule–surface interactions compared to metallic substrates. Here, we demonstrate the activation of substrate templating in molecular self-assembly on a bulk insulator by controlled deprotonation of the …
Water Adsorption on Clean and Defective Anatase TiO2 (001) Nanotube Surfaces: A Surface Science Approach
2018
We use ab initio molecular dynamics simulations to study the adsorption of thin water films with 1 and 2 ML coverage on anatase TiO2 (001) nanotubes. The nanotubes are modeled as 2D slabs, which consist of partially constrained and partially relaxed structural motifs from nanotubes. The effect of anion doping on the adsorption is investigated by substituting O atoms with N and S impurities on the nanotube slab surface. Due to strain-induced curvature effects, water adsorbs molecularly on defect-free surfaces via weak bonds on Ti sites and H bonds to surface oxygens. While the introduction of an S atom weakens the interaction of the surface with water, which adsorbs molecularly, the presence…
Dual-polarization-pump CW laser operation in Nd3+:LiNbO3 channel waveguides fabricated by reverse proton exchange
2008
Abstract In this work, continuous-wave laser action at 1084.5 nm at room temperature in LiNbO 3 :Nd 3+ channel waveguides, fabricated by reverse proton exchange (RPE), is reported. The sample was pumped at λ = 808 nm in either σ or π-polarized configurations, TE- and TM-pumping schemes, being the laser emission π-polarized at all power levels. The laser characteristics, as function of the pumping scheme (TE or TM), have been obtained. In both cases, the laser emission was stable, without any reduction in the output power even under continuous pump operation at maximum power at room temperature, indicating high resistance to photorefractive damage.
The next-generation liquid-scintillator neutrino observatory LENA
2012
We propose the liquid-scintillator detector LENA (Low Energy Neutrino Astronomy) as a next-generation neutrino observatory on the scale of 50 kt. The outstanding successes of the Borexino and KamLAND experiments demonstrate the large potential of liquid-scintillator detectors in low-energy neutrino physics. LENA's physics objectives comprise the observation of astrophysical and terrestrial neutrino sources as well as the investigation of neutrino oscillations. In the GeV energy range, the search for proton decay and long-baseline neutrino oscillation experiments complement the low-energy program. Based on the considerable expertise present in European and international research groups, the …
Luminescence of impyrity and radiation defects in magnesium oxide irradiated by fast neutrons
2009
Abstract The photoluminescence, its excitation and absorption spectra of MgO single crystals are investigated before and after the irradiation with fast neutrons. It is shown that the fast neutron irradiation leads to the formation of two types of centers: the interstitial proton H + i and the Mg(OH) 2 microphase. From the behaviour of the photoluminescence (PL) and its excitation (PLE) spectra we suppose that the photoluminescence band at 730 nm of the MgO crystals belongs to the complex V − OH − Fe 3+ centers, which is transformed during the irradiation with fast neutrons. The obtained results allow assume that the transitionions play an important role in the migration of vacancies and in…
βDelayed γRay spectroscopy of heavy neutron rich nuclei “south” of lead
2009
Relativistic projectile fragmentation of a 208Pb primary beam has been used to produce neutron-rich nuclei with proton-holes relative to the Z = 82 shell closure, i.e., “south” of Pb. βDelayed γRay spectroscopy allows to investigate the structural properties of such nuclei with A ~ 195 → 205. The current work presents transitions de-exciting excited states in 204Au, which are the first spectroscopic information on this N = 125 isotone. Agramunt Ros, Jorge, Jorge.Agramunt@ific.uv.es ; Algora, Alejandro, Alejandro.Algora@ific.uv.es ; Molina Palacios, Francisco Manuel, Francisco.Molina@ific.uv.es ; Rubio Barroso, Berta, Berta.Rubio@ific.uv.es
Dynamic nuclear polarisation of biological matter
1986
Polarised targets as used in high energy physics experiments may be of considerable interest in biological structure research using polarized neutrons. So far, this promising method has been facing difficulties in getting reasonable polarization of the target nuclei. We report on a polarized "frozen spin" target which has been prepared from an enzyme dissolved in a mixture of heavy water and deuterated propanediol doped with a completely deuterated paramagnetic radical. Clusters of 700 protons defined by the structure of lysozyme embedded in a fully deuterated matrix were polarized to 75% within an hour by 4 mm microwave irradiation in a magnetic field of 2.5 tesla at a temperature of 0.3 K…
Nanoassemblies Based on Supramolecular Complexes of Nonionic Amphiphilic Cyclodextrin and Sorafenib as Effective Weapons to Kill Human HCC Cells
2015
Sorafenib (Sor), an effective chemiotherapeutic drug utilized against hepatocellular carcinoma (HOC), robustly interacts with nonionic amphiphilic cyclodextrin (aCD, SC6OH), forming, in aqueous solution, supramolecular complexes that behave as building blocks of highly water-dispersible colloidal nanoassemblies. SC6OH/Sor complex has been characterized by complementary spectroscopic techniques, such as UV-vis, steady-state fluorescence and anisotropy, resonance light scattering and H-1 NMR. The spectroscopic evidences and experiments carried out in the presence of an adamantane derivative, which competes with drug for CD cavity, agree with the entrapment of Sor in aCD, pointing out the role…
Proton tautomerism in 2-nitramino-C-nitropyridine derivatives - Experimental and quantum chemical study
2019
Abstract The structures of 2-nitramino-3-nitropyridine and 2-nitramino-5-nitropyridine have been characterized by X-ray diffraction and Density Functional Theory (DFT) studies. In the crystals, both compounds exist as the imino forms. The DFT calculations were performed in order to explore the amino-imino tautomerism of the studied compounds in the gas phase and the influence of solvent polarity on the tautomeric equilibrium. The Harmonic Oscillator Model of Aromaticity index (HOMA) and Nucleus Independent Chemical Shift (NICS) calculated for the pyridine rings of the studied systems, demonstrated a noticeable decrease in aromaticity of the imino forms. This study showed also that the highe…
How Hydrogen Bonds Affect Reactivity and Intervalence Charge Transfer in Ferrocenium‐Phenolate Radicals
2016
The ferrocenyl-phenol 2,4-di-tert-butyl-6-(ferrocenylcarbamoyl)phenol (H-1) forms intramolecular hydrogen bonds which are absent in its constitutional isomer 2,6-di-tert-butyl-4-(ferrocenylcarbamoyl)phenol (H-2). Their corresponding bases 1– and 2– show intra- and intermolecular NH···O hydrogen bonds, respectively. The phenolate 1– is reversibly oxidized to 1·, whereas 2– only undergoes a quasi-reversible oxidation to 2·, which suggests a higher reactivity. The radical pools of 1· and 2· formed by the oxidation/deprotonation of H-1 and H-2 have been probed by (rapid-freeze) electron paramagnetic resonance (EPR) spectroscopy and by spin-trapping techniques to elucidate the types of radicals …