1,157 research outputs found
Promoter effect on the reduction behavior of wuestite-based catalysts for ammonia synthesis
Ammonia synthesis remains one of the most important catalytic processes since it enables efficient hydrogen storage and provides the basis for the production of fertilizers. Herein, complementary bulk and local analytical techniques were combined to investigate the effect of selected promoters (Al, K, Ca) on the reduction of wuestite into α-iron and their catalytic performance for ammonia synthesis. The use of promoters appears to have a positive effect on the wuestite-derived catalyst in ammonia synthesis. The promoters seemingly act as a binder for wuestite grains and impede the reduction and disproportionation events of wuestite precursors resulting in an increased catalytic performance. This effect is associated with an increase of surface area and mesoporosity. The study delivers new insights into the interplay of structure and promoters in wuestite-based catalysts
Polyhedral units and network connectivity in calcium aluminosilicate glasses from high-energy x-ray diffraction
Structure factors for Cax/2AlxSi1-xO2 glasses (x=0,0.25,0.5,0.67) extended to
a wave vector of magnitude Q= 40 1/A have been obtained by high-energy x-ray
diffraction. For the first time, it is possible to resolve the contributions of
Si-O, Al-O and Ca-O coordination polyhedra to the experimental atomic pair
distribution functions (PDF). It has been found that both Si and Al are
four-fold coordinated and so participate in a continuous tetrahedral network at
low values of x. The number of network breaking defects in the form of
non-bridging oxygens (NBO's) increases slowly with x until x=0.5 (NBO's ~ 10%
at x=0.5). By x=0.67 the network breaking defects become significant as
evidenced by the significant drop in the average coordination number of Si. By
contrast, Al-O tetrahedra remain free of NBO's and fully integrated in the
Al/Si-O network for all values of x. Calcium maintains a rather uniform
coordination sphere of approximately 5 oxygen atoms for all values of x. The
results suggest that not only Si/Al-O tetrahedra but Ca-O polyhedra, too, play
a role in determining the glassy structure
Cancer patients’ experiences of using an Interactive Health Communication Application (IHCA)
Interactive Health Communication Applications (IHCAs) are increasingly used in health care. Studies document that IHCAs provide patients with knowledge and social support, enhance self- efficacy and can improve behavioural and clinical outcomes. However, research exploring patients’ experiences of using IHCAs has been scarce. The aim of this study was to explore cancer patients’ perspectives and experiences related to the use of an IHCA called WebChoice in their homes. Qualitative interviews were conducted with infrequent, medium and frequent IHCA users—six women and four men with breast and prostate cancer. The interviews were transcribed and analyzed inspired by interactionistic perspectives. We found that some patients’ perceived WebChoice as a “friend,” others as a “stranger.” Access to WebChoice stimulated particularly high frequency users to position themselves as “information seeking agents,” assuming an active patient role. However, to position oneself as an “active patient” was ambiguous and emotional. Feelings of “calmness”, “normalization of symptoms”, feelings of “being part of a community”, feeling “upset” and “vulnerable”, as well as “feeling supported” were identified. Interaction with WebChoice implied for some users an increased focus on illness. Our findings indicate that the interaction between patients and an IHCA such as WebChoice occurs in a variety of ways, some of which are ambivalent or conflicting. Particularly for frequent and medium frequency users, it offers support, but may at the same time reinforce an element of uncertainty in their life. Such insights should be taken into consideration in the future development of IHCAs in healthcare in general and in particular for implementation into patients’ private sphere
Stellar Iron Abundances at the Galactic Center
We present measurements of [Fe/H] for six M supergiant stars and three giant
stars within 0.5 pc of the Galactic Center (GC) and one M supergiant star
within 30 pc of the GC. The results are based on high-resolution (lambda /
Delta lambda =40,000) K-band spectra, taken with CSHELL at the NASA Infrared
Telescope Facility.We determine the iron abundance by detailed abundance
analysis,performed with the spectral synthesis program MOOG.The mean [Fe/H] of
the GC stars is determined to be near solar,[Fe/H] = +0.12 0.22. Our
analysis is a differential analysis, as we have observed and applied the same
analysis technique to eleven cool, luminous stars in the solar neighborhood
with similar temperatures and luminosities as the GC stars. The mean [Fe/H] of
the solar neighborhood comparison stars, [Fe/H] = +0.03 0.16, is similar
to that of the GC stars. The width of the GC [Fe/H] distribution is found to be
narrower than the width of the [Fe/H] distribution of Baade's Window in the
bulge but consistent with the width of the [Fe/H] distribution of giant and
supergiant stars in the solar neighborhood.Comment: 41 pages, 9 figures, ApJ, in pres
Online Bayesian Optimization for a Recoil Mass Separator
The SEparator for CApture Reactions (SECAR) is a next-generation recoil
separator system at the Facility for Rare Isotope Beams (FRIB) designed for the
direct measurement of capture reactions on unstable nuclei in inverse
kinematics. To maximize the performance of this system, stringent requirements
on the beam alignment to the central beam axis and on the ion-optical settings
need to be achieved. These can be difficult to attain through manual tuning by
human operators without potentially leaving the system in a sub-optimal and
irreproducible state. In this work, we present the first development of online
Bayesian optimization with a Gaussian process model to tune an ion beam through
a nuclear astrophysics recoil separator. We show that this method achieves
small incoming angular deviations (\textless 1 mrad) in an efficient and
reproducible manner that is at least three times faster than standard
hand-tuning. Additionally, we present a Bayesian method for experimental
optimization of the ion optics, and show that it validates the nominal
theoretical ion-optical settings of the device, and improves the mass
separation by 32\% for some beams
Local structure study of In_xGa_(1-x)As semiconductor alloys using High Energy Synchrotron X-ray Diffraction
Nearest and higher neighbor distances as well as bond length distributions
(static and thermal) of the In_xGa_(1-x)As (0<x<1) semiconductor alloys have
been obtained from high real-space resolution atomic pair distribution
functions (PDFs). Using this structural information, we modeled the local
atomic displacements in In_xGa_(1-x)As alloys. From a supercell model based on
the Kirkwood potential, we obtained 3-D As and (In,Ga) ensemble averaged
probability distributions. This clearly shows that As atom displacements are
highly directional and can be represented as a combination of and
displacements. Examination of the Kirkwood model indicates that the standard
deviation (sigma) of the static disorder on the (In,Ga) sublattice is around
60% of the value on the As sublattice and the (In,Ga) atomic displacements are
much more isotropic than those on the As sublattice. The single crystal diffuse
scattering calculated from the Kirkwood model shows that atomic displacements
are most strongly correlated along directions.Comment: 10 pages, 12 figure
Evidence for charge localization in the ferromagnetic phase of La_(1-x)Ca_(x)MnO_3 from High real-space-resolution x-ray diffraction
High real-space-resolution atomic pair distribution functions of
La_(1-x)Ca_(x)MnO_3 (x=0.12, 0.25 and 0.33) have been measured using
high-energy x-ray powder diffraction to study the size and shape of the MnO_6
octahedron as a function of temperature and doping. In the paramagnetic
insulating phase we find evidence for three distinct bond-lengths (~ 1.88, 1.95
and 2.15A) which we ascribe to Mn^{4+}-O, Mn^{3+}-O short and Mn^{3+}-O long
bonds respectively. In the ferromagnetic metallic (FM) phase, for x=0.33 and
T=20K, we find a single Mn-O bond-length; however, as the metal-insulator
transition is approached either by increasing T or decreasing x, intensity
progressively appears around r=2.15 and in the region 1.8 - 1.9A suggesting the
appearance of Mn^{3+}-O long bonds and short Mn^{4+}-O bonds. This is strong
evidence that charge localized and delocalized phases coexist close to the
metal-insulator transition in the FM phase.Comment: 8 pages, 8 postscript figures, submitted to Phys. Rev.
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