298 research outputs found
Fluctuations within the Hydrogen Bond Network Modulate Cooperativity Across the Conformational Ensemble of Protein Structures
The electronic structure of LaSrMnO thin films and its dependence as studied by angle-resolved photoemission
We present angle-resolved photoemission spectroscopy results for thin films
of the three-dimensional manganese perovskite LaSrMnO. We
show that the transition temperature () from the paramagnetic insulating
to ferromagnetic metallic state is closely related to details of the electronic
structure, particularly to the spectral weight at the -point, where
the sharpest step at the Fermi level was observed. We found that this -point is the same for all the samples, despite their different . The
change of is discussed in terms of kinetic energy optimization. Our ARPES
results suggest that the change of the electronic structure for the samples
having different transition temperatures is different from the rigid band
shift.Comment: Accepted by Journal of Physics: Condensed Matte
Redistribution of Flexibility in Stabilizing Antibody Fragment Mutants Follows Le Chatelier's Principle
Le Châtelier's principle is the cornerstone of our understanding of chemical equilibria. When a system at equilibrium undergoes a change in concentration or thermodynamic state (i.e., temperature, pressure, etc.), La Châtelier's principle states that an equilibrium shift will occur to offset the perturbation and a new equilibrium is established. We demonstrate that the effects of stabilizing mutations on the rigidity ⇔ flexibility equilibrium within the native state ensemble manifest themselves through enthalpy-entropy compensation as the protein structure adjusts to restore the global balance between the two. Specifically, we characterize the effects of mutation to single chain fragments of the anti-lymphotoxin-β receptor antibody using a computational Distance Constraint Model. Statistically significant changes in the distribution of both rigidity and flexibility within the molecular structure is typically observed, where the local perturbations often lead to distal shifts in flexibility and rigidity profiles. Nevertheless, the net gain or loss in flexibility of individual mutants can be skewed. Despite all mutants being exclusively stabilizing in this dataset, increased flexibility is slightly more common than increased rigidity. Mechanistically the redistribution of flexibility is largely controlled by changes in the H-bond network. For example, a stabilizing mutation can induce an increase in rigidity locally due to the formation of new H-bonds, and simultaneously break H-bonds elsewhere leading to increased flexibility distant from the mutation site via Le Châtelier. Increased flexibility within the VH β4/β5 loop is a noteworthy illustration of this long-range effect
The Single-Particle Structure of Neutron-Rich Nuclei of Astrophysical Interest at the Ornl Hribf
The rapid nuetron-capture process (r process) produces roughly half of the
elements heavier than iron. The path and abundances produced are uncertain,
however, because of the lack of nuclear strucure information on important
neutron-rich nuclei. We are studying nuclei on or near the r-process path via
single-nucleon transfer reactions on neutron-rich radioactive beams at ORNL's
Holifield Radioactive Ion Beam Facility (HRIBF). Owing to the difficulties in
studying these reactions in inverse kinematics, a variety of experimental
approaches are being developed. We present the experimental methods and initial
results.Comment: Proceedings of the Third International Conference on Fission and
Properties of Neutron-Rich Nucle
Direct reaction measurements with a 132Sn radioactive ion beam
The (d,p) neutron transfer and (d,d) elastic scattering reactions were
measured in inverse kinematics using a radioactive ion beam of 132Sn at 630
MeV. The elastic scattering data were taken in a region where Rutherford
scattering dominated the reaction, and nuclear effects account for less than 8%
of the cross section. The magnitude of the nuclear effects was found to be
independent of the optical potential used, allowing the transfer data to be
normalized in a reliable manner. The neutron-transfer reaction populated a
previously unmeasured state at 1363 keV, which is most likely the
single-particle 3p1/2 state expected above the N=82 shell closure. The data
were analyzed using finite range adiabatic wave calculations and the results
compared with the previous analysis using the distorted wave Born
approximation. Angular distributions for the ground and first excited states
are consistent with the previous tentative spin and parity assignments.
Spectroscopic factors extracted from the differential cross sections are
similar to those found for the one neutron states beyond the benchmark
doubly-magic nucleus 208Pb.Comment: 22 pages, 7 figure
Orbit spaces of free involutions on the product of two projective spaces
Let be a finitistic space having the mod 2 cohomology algebra of the
product of two projective spaces. We study free involutions on and
determine the possible mod 2 cohomology algebra of orbit space of any free
involution, using the Leray spectral sequence associated to the Borel fibration
. We also
give an application of our result to show that if has the mod 2 cohomology
algebra of the product of two real projective spaces (respectively complex
projective spaces), then there does not exist any -equivariant
map from for (respectively ), where
is equipped with the antipodal involution.Comment: 14 pages, to appear in Results in Mathematic
Fermi surface of the colossal magnetoresistance perovskite La_{0.7}Sr_{0.3}MnO_{3}
Materials that exhibit colossal magnetoresistance (CMR) are currently the
focus of an intense research effort, driven by the technological applications
that their sensitivity lends them to. Using the angular correlation of photons
from electron-positron annihilation, we present a first glimpse of the Fermi
surface of a material that exhibits CMR, supported by ``virtual crystal''
electronic structure calculations. The Fermi surface is shown to be
sufficiently cubic in nature that it is likely to support nesting.Comment: 5 pages, 5 PS figure
Nesting properties and anisotropy of the Fermi surface of LuNiBC
The rare earth nickel borocarbides, with the generic formula
NiBC, have recently been shown to display a rich variety of
phenomena. Most striking has been the competition between, and even coexistence
of, antiferromagnetism and superconductivity. We have measured the Fermi
surface (FS) of LuNiBC, and shown that it possesses nesting
features capable of explaining some of the phenomena experimentally observed.
In particular, it had previously been conjectured that a particular sheet of FS
is responsible for the modulated magnetic structures manifest in some of the
series. We report the first direct experimental observation of this sheet.Comment: 4 pages, 4 PS figure
The magic nature of 132Sn explored through the single-particle states of 133Sn
Atomic nuclei have a shell structure where nuclei with 'magic numbers' of
neutrons and protons are analogous to the noble gases in atomic physics. Only
ten nuclei with the standard magic numbers of both neutrons and protons have so
far been observed. The nuclear shell model is founded on the precept that
neutrons and protons can move as independent particles in orbitals with
discrete quantum numbers, subject to a mean field generated by all the other
nucleons. Knowledge of the properties of single-particle states outside nuclear
shell closures in exotic nuclei is important for a fundamental understanding of
nuclear structure and nucleosynthesis (for example the r-process, which is
responsible for the production of about half of the heavy elements). However,
as a result of their short lifetimes, there is a paucity of knowledge about the
nature of single-particle states outside exotic doubly magic nuclei. Here we
measure the single-particle character of the levels in 133Sn that lie outside
the double shell closure present at the short-lived nucleus 132Sn. We use an
inverse kinematics technique that involves the transfer of a single nucleon to
the nucleus. The purity of the measured single-particle states clearly
illustrates the magic nature of 132Sn.Comment: 19 pages, 5 figures and 4 table
Spin Wave Theory of Double Exchange Ferromagnets
We construct the 1/S spin-wave expansion for double exchange ferromagnets at
T=0. It is assumed that the value of Hund's rule coupling, J_H, is sufficiently
large, resulting in a fully saturated, ferromagnetic half-metallic ground
state. We evaluate corrections to the magnon dispersion law, and we also find
that, in contrast to earlier statements in the literature, magnon-electron
scattering does give rise to spin wave damping. We analyse the momentum
dependence of these quantities and discuss the experimental implications for
colossal magnetoresistance compounds.Comment: 4 pages, Latex-Revtex, 2 PostScript figures. Minor revisions,
references added. See also cond-mat/990921
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