554 research outputs found
Detailed studies of non-linear magneto-optical resonances at D1 excitation of Rb-85 and Rb-87 for partially resolved hyperfine F-levels
Experimental signals of non-linear magneto-optical resonances at D1
excitation of natural rubidium in a vapor cell have been obtained and described
with experimental accuracy by a detailed theoretical model based on the optical
Bloch equations. The D1 transition of rubidium is a challenging system to
analyze theoretically because it contains transitions that are only partially
resolved under Doppler broadening. The theoretical model took into account all
nearby transitions, the coherence properties of the exciting laser radiation,
and the mixing of magnetic sublevels in an external magnetic field and also
included averaging over the Doppler profile. Great care was taken to obtain
accurate experimental signals and avoid systematic errors. The experimental
signals were reproduced very well at each hyperfine transition and over a wide
range of laser power densities, beam diameters, and laser detunings from the
exact transition frequency. The bright resonance expected at the F_g=1 -->
F_e=2 transition of Rb-87 has been observed. A bright resonance was observed at
the F_g=2 --> F_e=3 transition of Rb-85, but displaced from the exact position
of the transition due to the influence of the nearby F_g=2 --> F_e=2
transition, which is a dark resonance whose contrast is almost two orders of
magnitude larger than the contrast of the bright resonance at the F_g=2 -->
F_e=3 transition. Even in this very delicate situation, the theoretical model
described in detail the experimental signals at different laser detunings.Comment: 11 pages, 9 figure
Efficient nonlinear room-temperature spin injection from ferromagnets into semiconductors through a modified Schottky barrier
We suggest a consistent microscopic theory of spin injection from a
ferromagnet (FM) into a semiconductor (S). It describes tunneling and emission
of electrons through modified FM-S Schottky barrier with an ultrathin heavily
doped interfacial S layer . We calculate nonlinear spin-selective properties of
such a reverse-biased FM-S junction, its nonlinear I-V characteristic, current
saturation, and spin accumulation in S. We show that the spin polarization of
current, spin density, and penetration length increase with the total current
until saturation. We find conditions for most efficient spin injection, which
are opposite to the results of previous works, since the present theory
suggests using a lightly doped resistive semiconductor. It is shown that the
maximal spin polarizations of current and electrons (spin accumulation) can
approach 100% at room temperatures and low current density in a nondegenerate
high-resistance semiconductor.Comment: 7 pages, 2 figures; provides detailed comparison with earlier works
on spin injectio
Structural and chemical embrittlement of grain boundaries by impurities: a general theory and first principles calculations for copper
First principles calculations of the Sigma 5 (310)[001] symmetric tilt grain
boundary in Cu with Bi, Na, and Ag substitutional impurities provide evidence
that in the phenomenon of Bi embrittlement of Cu grain boundaries electronic
effects do not play a major role; on the contrary, the embrittlement is mostly
a structural or "size" effect. Na is predicted to be nearly as good an
embrittler as Bi, whereas Ag does not embrittle the boundary in agreement with
experiment. While we reject the prevailing view that "electronic" effects
(i.e., charge transfer) are responsible for embrittlement, we do not exclude
the role of chemistry. However numerical results show a striking equivalence
between the alkali metal Na and the semi metal Bi, small differences being
accounted for by their contrasting "size" and "softness" (defined here). In
order to separate structural and chemical effects unambiguously if not
uniquely, we model the embrittlement process by taking the system of grain
boundary and free surfaces through a sequence of precisely defined gedanken
processes; each of these representing a putative mechanism. We thereby identify
three mechanisms of embrittlement by substitutional impurities, two of which
survive in the case of embrittlement or cohesion enhancement by interstitials.
Two of the three are purely structural and the third contains both structural
and chemical elements that by their very nature cannot be further unravelled.
We are able to take the systems we study through each of these stages by
explicit computer simulations and assess the contribution of each to the nett
reduction in intergranular cohesion. The conclusion we reach is that
embrittlement by both Bi and Na is almost exclusively structural in origin;
that is, the embrittlement is a size effect.Comment: 13 pages, 5 figures; Accepted in Phys. Rev.
Structure and Magnetism of Neutral and Anionic Palladium Clusters
The properties of neutral and anionic Pd_N clusters were investigated with
spin-density-functional calculations. The ground state structures are
three-dimensional for N>3 and they are magnetic with a spin-triplet for 2<=N<=7
and a spin nonet for N=13 neutral clusters. Structural- and spin-isomers were
determined and an anomalous increase of the magnetic moment with temperature is
predicted for a Pd_7 ensemble. Vertical electron detachment and ionization
energies were calculated and the former agree well with measured values for
anionic Pd_N clusters.Comment: 5 pages, 3 figures, fig. 2 in color, accepted to Phys. Rev. Lett.
(2001
Dynamics of monatomic liquids
We present a theory of the dynamics of monatomic liquids built on two basic
ideas: (1) The potential surface of the liquid contains three classes of
intersecting nearly-harmonic valleys, one of which (the ``random'' class)
vastly outnumbers the others and all whose members have the same depth and
normal mode spectrum; and (2) the motion of particles in the liquid can be
decomposed into oscillations in a single many-body valley, and nearly
instantaneous inter-valley transitions called transits. We review the
thermodynamic data which led to the theory, and we discuss the results of
molecular dynamics (MD) simulations of sodium and Lennard-Jones argon which
support the theory in more detail. Then we apply the theory to problems in
equilibrium and nonequilibrium statistical mechanics, and we compare the
results to experimental data and MD simulations. We also discuss our work in
comparison with the QNM and INM research programs and suggest directions for
future research.Comment: 53 pages, 16 figures. Differs from published version in using
American English spelling and grammar (published version uses British
English
Surface relaxation and ferromagnetism of Rh(001)
The significant discrepancy between first-principles calculations and
experimental analyses for the relaxation of the (001) surface of rhodium has
been a puzzle for some years. In this paper we present density functional
theory calculations using the local-density approximation and the generalized
gradient approximation of the exchange-correlation functional. We investigate
the thermal expansion of the surface and the possibility of surface magnetism.
The results throw light on several, hitherto overlooked, aspects of metal
surfaces. We find, that, when the free energy is considered, density-functional
theory provides results in good agreement with experiments.Comment: 6 pages, 4 figures, submitted to Phys. Rev. Lett. (April 28, 1996
From bi-layer to tri-layer Fe nanoislands on Cu3Au(001)
Self assembly on suitably chosen substrates is a well exploited root to
control the structure and morphology, hence magnetization, of metal films. In
particular, the Cu3Au(001) surface has been recently singled out as a good
template to grow high spin Fe phases, due to the close matching between the
Cu3Au lattice constant (3.75 Angstrom) and the equilibrium lattice constant for
fcc ferromagnetic Fe (3.65 Angstrom). Growth proceeds almost layer by layer at
room temperature, with a small amount of Au segregation in the early stage of
deposition. Islands of 1-2 nm lateral size and double layer height are formed
when 1 monolayer of Fe is deposited on Cu3Au(001) at low temperature. We used
the PhotoElectron Diffraction technique to investigate the atomic structure and
chemical composition of these nanoislands just after the deposition at 140 K
and after annealing at 400 K. We show that only bi-layer islands are formed at
low temperature, without any surface segregation. After annealing, the Fe atoms
are re-aggregated to form mainly tri-layer islands. Surface segregation is
shown to be inhibited also after the annealing process. The implications for
the film magnetic properties and the growth model are discussed.Comment: Revtex, 5 pages with 4 eps figure
Full potential LAPW calculation of electron momentum density and related properties of Li
Electron momentum density and Compton profiles in Lithium along , and directions are calculated using Full-Potential Linear
Augmented Plane Wave basis within generalized gradient approximation. The
profiles have been corrected for correlations with Lam-Platzman formulation
using self-consistent charge density. The first and second derivatives of
Compton profiles are studied to investigate the Fermi surface breaks. Decent
agreement is observed between recent experimental and our calculated values.
Our values for the derivatives are found to be in better agreement with
experiments than earlier theoretical results. Two-photon momentum density and
one- and two-dimensional angular correlation of positron annihilation radiation
are also calculated within the same formalism and including the
electron-positron enhancement factor.Comment: 11 pages, 7 figures TO appear in Physical Review
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