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  • 1
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 114 (2001), S. 2698-2706 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: To explore how a structured excess charge distribution affects the hydration of an anion, we report mid-IR, argon predissociation spectra for the hydrated superoxide cluster anions, O2−⋅(H2O)n, 1≤n≤5. This size range was chosen to establish the evolution of the structures through the putative shell closing [Weber et al., Science 287, 2461 (2000)] for superoxide hydration at the tetrahydrate. Whereas the observed bonding motifs for n≤4 are those of single water molecules and dimeric subclusters bound to the ion, the pentahydrate spectrum displays strong bands in the region typically associated with ring modes of the water trimer. The present results reinforce the conclusion that the tetrahydrate adopts an especially robust structure in which each water molecule forms a single ionic H bond to one of the lobes of the π* highest occupied molecular orbital in superoxide. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 116 (2002), S. 6411-6421 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: An approach in which the total energy of interacting subsystems is expressed as a bifunctional depending explicitly on two functions: electron densities of the two molecules forming a complex (ρ1 and ρ2) was used to determine the equilibrium geometry and the binding energy of several weak intermolecular complexes involving carbazole and such atoms or molecules as Ne, Ar, CH4, CO, and N2. For these complexes, the experimental dissociation energies fall within the range from 0.48 to 2.06 kcal/mol. Since the effect of the intermolecular vibrations on the dissociation energy is rather small, the experimental measurements provide an excellent reference set. The obtained interaction energies are in a good agreement with experiment and are superior to the ones derived from conventional Kohn–Sham calculations. A detailed analysis of relative contribution of the terms which are expressed using approximate functionals (i.e., exchange-correlation Exc[ρ1+ρ2] and nonadditive kinetic energy Tsnad[ρ1,ρ2]=Ts[ρ1+ρ2]−Ts[ρ1]−Ts[ρ2]) is made. The nonvariational version of the applied formalism is also discussed. © 2002 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 115 (2001), S. 10718-10723 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: Photodetachment spectra of CH3NO2−⋅Arn clusters in the mid-IR are dominated by three strong resonances. These are assigned to autodetaching (AD) C–H stretching vibrational transitions in the valence (as opposed to dipole-bound) form of the molecular anion on the basis of a H/D isotopic substitution study and their solvation dependence. The AD resonances disappear promptly upon addition of the third argon atom, while the resonant structure appears in the action spectrum for formation of CH3NO2− photoproducts for n≥2. The strong argon solvation dependence of the photoproducts is traced to the rapidly changing endoergicity of the electron loss channel due to the differential solvation behavior of the valence anion relative to the neutral. We discuss a statistical limit for this competition, and introduce an intramolecular vibrational energy redistribution mediated AD mechanism unique to polyatomic anions. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 4
    ISSN: 1476-4687
    Source: Nature Archives 1869 - 2009
    Topics: Biology , Chemistry and Pharmacology , Medicine , Natural Sciences in General , Physics
    Notes: [Auszug] Stem cell fate is influenced by specialized microenvironments that remain poorly defined in mammals. To explore the possibility that haematopoietic stem cells derive regulatory information from bone, accounting for the localization of haematopoiesis in bone marrow, we assessed mice that were ...
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    Westerville, Ohio : American Ceramics Society
    Journal of the American Ceramic Society 85 (2002), S. 0 
    ISSN: 1551-2916
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Physics
    Notes: Single-phase glasses containing 37.5 mol% Y2O3, 7 mol% La2O3, and 1 mol% Pr, Ho, Nd, Er, Sm, Tm, Eu, or Yb oxide substituted for part of the Y2O3 were synthesized by containerless melting. The spectral transmission and absorption cross sections of the glasses were determined at wavelengths from 360 to 3300 nm. The electronic transitions were broadened compared with results obtained in a crystalline yttrium aluminum garnet (YAG) host. The infrared transmission of the host glass extended to 6000 nm. The optical and physicochemical properties of these glasses are well suited for optical device applications.
    Type of Medium: Electronic Resource
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  • 6
    Electronic Resource
    Electronic Resource
    [S.l.] : American Institute of Physics (AIP)
    Review of Scientific Instruments 72 (2001), S. 4098-4105 
    ISSN: 1089-7623
    Source: AIP Digital Archive
    Topics: Physics , Electrical Engineering, Measurement and Control Technology
    Notes: The results of experimental and theoretical studies, aiming at a quantitative characterization of photoion-induced energy broadening effects in a laser photoelectron source, are reported. The electron source is based on two-step cw laser photoionization of potassium atoms in a collimated beam. In the experimental studies, the attachment spectra for the formation of (N2O)9O− cluster ions through a narrow vibrational Feshbach resonance (full width at half maximum 2.3 meV) were measured as a function of the photocurrent. The theoretical studies involved Monte Carlo simulations of the broadening effects and were based on potential distributions caused by realistic spatial distributions of the photoions. Using the corresponding electric field distribution, trajectories were calculated for a representative ensemble of electrons, and effective electron energy distributions were obtained from averages over the electron trajectories in the volume relevant for electron attachment. Furthermore, the effects of additional weak electric fields, applied along the atomic beam direction, have been simulated. For our geometry (ionization volume about 2 mm3) the effective space charge related energy width is found to be about 16 μeV/pA. © 2001 American Institute of Physics.
    Type of Medium: Electronic Resource
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  • 7
    Electronic Resource
    Electronic Resource
    Westerville, Ohio : American Ceramics Society
    Journal of the American Ceramic Society 83 (2000), S. 0 
    ISSN: 1551-2916
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Physics
    Notes: We report formation of single- and two-phase glasses from rare-earth oxide–alumina materials. Liquids with the Y3Al5O12 and Er3Al5O12 compositions underwent a liquid–liquid phase transition which resulted in glasses with a cloudy appearance due to spheroids of one glass in a matrix of a second glass. The two glasses were isocompositional within the limits of experimental error. Clear, brilliant, single-phase glasses were obtained from La3Al5O12, ErLaYAl5O12, and compositions containing ≥5 mol% La2O3 substituted for the other rare-earth oxides. Formation of two glasses is attributed to nucleation and growth of the second liquid at a temperature below the equilibrium liquid–liquid transition temperature. Addition of lanthanum depresses the phase transition temperature below the glass transition temperature and the liquid–liquid phase transition is not observed. The results are discussed in the context of first-order liquid–liquid phase transitions (polyamorphism) and formation of single-phase glass from liquids that contain a high proportion of 4-coordinate aluminum ions.
    Type of Medium: Electronic Resource
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  • 8
    Electronic Resource
    Electronic Resource
    Westerville, Ohio : American Ceramics Society
    Journal of the American Ceramic Society 83 (2000), S. 0 
    ISSN: 1551-2916
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Physics
    Notes: We report the first measurements of the structure factor, S(Q), and the pair distribution function, G(r), of Al6Si2O13 (3:2 mullite) in the normal and supercooled liquid states in the temperature range 1776–2203 K. Measurements are obtained by synchrotron X-ray scattering on levitated, laser-heated liquid specimens. The S(Q) shows a prepeak at 2.0 Å−1 followed by a main peak at 4.5 Å−1 and a weak feature at 8 Å−1. The G(r) shows a strong (Si,Al)–O correlation at 1.80 Å at high temperature that moves to 1.72 Å as the liquid is supercooled. The second and third nearest neighbor peaks at 3.0 and 4.25 Å sharpen with supercooling. The short-range structure of the high-temperature liquid is similar to the corresponding glasses produced by rapid quenching. Supercooling causes an increase in the concentration of tetrahedral Si4+ ions, which is manifested by the large shift in the first peak to lower ionic distance, r, values in G(r). The increase in tetrahedrally coordinated Si4+ ions is offset by an increase in octahedral Al3+ ions. The clustering of the SiO44− tetrahedral units results in increased viscosity of the liquid at temperatures below the melting point, which is consistent with Al6Si2O13 being a fragile liquid.
    Type of Medium: Electronic Resource
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  • 9
    Electronic Resource
    Electronic Resource
    Oxford, UK : Blackwell Science Ltd
    Journal of applied ichthyology 18 (2002), S. 0 
    ISSN: 1439-0426
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Biology , Agriculture, Forestry, Horticulture, Fishery, Domestic Science, Nutrition
    Type of Medium: Electronic Resource
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  • 10
    ISSN: 1439-0973
    Keywords: Key WordsAbsidia corymbifera ; Mucormycosis ; Acute myeloid leukemia ; Neutropenia ; Vasculitis
    Source: Springer Online Journal Archives 1860-2000
    Topics: Medicine
    Notes: Summary An 18-year-old woman was admitted to hospital because of subcutaneous hematoma and fever of unknown origin. Acute myeloid leukemia was diagnosed and empirical antimicrobial treatment and induction chemotherapy were started. After initial defervescence, fever relapsed 21 days after the onset of neutropenia. The CT scan of the lung was consistent with an invasive fungal infection. Treatment with amphotericin B was started and antimicrobial treatment was continued with liposomal amphotericin B because of an increase in creatinine later. The fever persisted and the patient suddenly developed progressive neurological symptoms. CT scan of the head suggested cerebral infarction and angiography of the extra- and intracranial arteries showed signs of vasculitis. Six days after the onset of neurological symptoms cerebral death was diagnosed. Autopsy revealed non-septate, irregularly branched hyphae in various histologic sections including brain. Absidia corymbifera could be isolated from lung tissue confirming the diagnosis of disseminated mucormycosis. In this case, angiographic findings suggested severe cerebral vasculitis which was in fact caused by thromboembolic dissemination of fungal hyphae. This case underlines the fact that cerebral symptoms in febrile neutropenic patients are highly indicative for fungal infections of the brain.
    Type of Medium: Electronic Resource
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