259 research outputs found
Valley filter and valley valve in graphene
It is known that the lowest propagating mode in a narrow ballistic ribbon of
graphene may lack the twofold valley degeneracy of higher modes. Depending on
the crystallographic orientation of the ribbon axis, the lowest mode mixes both
valleys or lies predominantly in a single valley (chosen by the direction of
propagation). We show, using a tight-binding model calculation, that a
nonequilibrium valley polarization can be realized in a sheet of graphene, upon
injection of current through a ballistic point contact with zigzag edges. The
polarity can be inverted by local application of a gate voltage to the point
contact region. Two valley filters in series may function as an
electrostatically controlled ``valley valve'', representing a
zero-magnetic-field counterpart to the familiar spin valve.Comment: RevTeX, 4 pages, 5 figure
Bipolar supercurrent in graphene
Graphene -a recently discovered one-atom-thick layer of graphite- constitutes
a new model system in condensed matter physics, because it is the first
material in which charge carriers behave as massless chiral relativistic
particles. The anomalous quantization of the Hall conductance, which is now
understood theoretically, is one of the experimental signatures of the peculiar
transport properties of relativistic electrons in graphene. Other unusual
phenomena, like the finite conductivity of order 4e^2/h at the charge
neutrality (or Dirac) point, have come as a surprise and remain to be
explained. Here, we study the Josephson effect in graphene. Our experiments
rely on mesoscopic superconducting junctions consisting of a graphene layer
contacted by two closely spaced superconducting electrodes, where the charge
density can be controlled by means of a gate electrode. We observe a
supercurrent that, depending on the gate voltage, is carried by either
electrons in the conduction band or by holes in the valence band. More
importantly, we find that not only the normal state conductance of graphene is
finite, but also a finite supercurrent can flow at zero charge density. Our
observations shed light on the special role of time reversal symmetry in
graphene and constitute the first demonstration of phase coherent electronic
transport at the Dirac point.Comment: Under review, 12 pages, 4 Figs., suppl. info (v2 identical, resolved
file problems
Aharonov-Bohm interferences from local deformations in graphene
One of the most interesting aspects of graphene is the tied relation between
structural and electronic properties. The observation of ripples in the
graphene samples both free standing and on a substrate has given rise to a very
active investigation around the membrane-like properties of graphene and the
origin of the ripples remains as one of the most interesting open problems in
the system. The interplay of structural and electronic properties is
successfully described by the modelling of curvature and elastic deformations
by fictitious gauge fields that have become an ex- perimental reality after the
suggestion that Landau levels can form associated to strain in graphene and the
subsequent experimental confirmation. Here we propose a device to detect
microstresses in graphene based on a scanning-tunneling-microscopy setup able
to measure Aharonov-Bohm inter- ferences at the nanometer scale. The
interferences to be observed in the local density of states are created by the
fictitious magnetic field associated to elastic deformations of the sample.Comment: Some bugs fixe
Energy gaps, topological insulator state and zero-field quantum Hall effect in graphene by strain engineering
Among many remarkable qualities of graphene, its electronic properties
attract particular interest due to a massless chiral character of charge
carriers, which leads to such unusual phenomena as metallic conductivity in the
limit of no carriers and the half-integer quantum Hall effect (QHE) observable
even at room temperature [1-3]. Because graphene is only one atom thick, it is
also amenable to external influences including mechanical deformation. The
latter offers a tempting prospect of controlling graphene's properties by
strain and, recently, several reports have examined graphene under uniaxial
deformation [4-8]. Although the strain can induce additional Raman features
[7,8], no significant changes in graphene's band structure have been either
observed or expected for realistic strains of approx. 10% [9-11]. Here we show
that a designed strain aligned along three main crystallographic directions
induces strong gauge fields [12-14] that effectively act as a uniform magnetic
field exceeding 10 T. For a finite doping, the quantizing field results in an
insulating bulk and a pair of countercirculating edge states, similar to the
case of a topological insulator [15-20]. We suggest realistic ways of creating
this quantum state and observing the pseudo-magnetic QHE. We also show that
strained superlattices can be used to open significant energy gaps in
graphene's electronic spectrum
A mathematical and computational review of Hartree-Fock SCF methods in Quantum Chemistry
We present here a review of the fundamental topics of Hartree-Fock theory in
Quantum Chemistry. From the molecular Hamiltonian, using and discussing the
Born-Oppenheimer approximation, we arrive to the Hartree and Hartree-Fock
equations for the electronic problem. Special emphasis is placed in the most
relevant mathematical aspects of the theoretical derivation of the final
equations, as well as in the results regarding the existence and uniqueness of
their solutions. All Hartree-Fock versions with different spin restrictions are
systematically extracted from the general case, thus providing a unifying
framework. Then, the discretization of the one-electron orbitals space is
reviewed and the Roothaan-Hall formalism introduced. This leads to a exposition
of the basic underlying concepts related to the construction and selection of
Gaussian basis sets, focusing in algorithmic efficiency issues. Finally, we
close the review with a section in which the most relevant modern developments
(specially those related to the design of linear-scaling methods) are commented
and linked to the issues discussed. The whole work is intentionally
introductory and rather self-contained, so that it may be useful for non
experts that aim to use quantum chemical methods in interdisciplinary
applications. Moreover, much material that is found scattered in the literature
has been put together here to facilitate comprehension and to serve as a handy
reference.Comment: 64 pages, 3 figures, tMPH2e.cls style file, doublesp, mathbbol and
subeqn package
Resonant tunnelling between the chiral Landau states of twisted graphene lattices
A class of multilayered functional materials has recently emerged in which the component atomic layers are held together by weak van der Waals forces that preserve the structural integrity and physical properties of each layer. An exemplar of such a structure is a transistor device in which relativistic Dirac Fermions can resonantly tunnel through a boron nitride barrier, a few atomic layers thick, sandwiched between two graphene electrodes. An applied magnetic field quantises graphene's gapless conduction and valence band states into discrete Landau levels, allowing us to resolve individual inter-Landau level transitions and thereby demonstrate that the energy, momentum and chiral properties of the electrons are conserved in the tunnelling process. We also demonstrate that the change in the semiclassical cyclotron trajectories, following an inter-layer tunnelling event, is analogous to the case of intra-layer Klein tunnelling
Jet energy measurement with the ATLAS detector in proton-proton collisions at root s=7 TeV
The jet energy scale and its systematic uncertainty are determined for jets measured with the ATLAS detector at the LHC in proton-proton collision data at a centre-of-mass energy of √s = 7TeV corresponding to an integrated luminosity of 38 pb-1. Jets are reconstructed with the anti-kt algorithm with distance parameters R=0. 4 or R=0. 6. Jet energy and angle corrections are determined from Monte Carlo simulations to calibrate jets with transverse momenta pT≥20 GeV and pseudorapidities {pipe}η{pipe}<4. 5. The jet energy systematic uncertainty is estimated using the single isolated hadron response measured in situ and in test-beams, exploiting the transverse momentum balance between central and forward jets in events with dijet topologies and studying systematic variations in Monte Carlo simulations. The jet energy uncertainty is less than 2. 5 % in the central calorimeter region ({pipe}η{pipe}<0. 8) for jets with 60≤pT<800 GeV, and is maximally 14 % for pT<30 GeV in the most forward region 3. 2≤{pipe}η{pipe}<4. 5. The jet energy is validated for jet transverse momenta up to 1 TeV to the level of a few percent using several in situ techniques by comparing a well-known reference such as the recoiling photon pT, the sum of the transverse momenta of tracks associated to the jet, or a system of low-pT jets recoiling against a high-pT jet. More sophisticated jet calibration schemes are presented based on calorimeter cell energy density weighting or hadronic properties of jets, aiming for an improved jet energy resolution and a reduced flavour dependence of the jet response. The systematic uncertainty of the jet energy determined from a combination of in situ techniques is consistent with the one derived from single hadron response measurements over a wide kinematic range. The nominal corrections and uncertainties are derived for isolated jets in an inclusive sample of high-pT jets. Special cases such as event topologies with close-by jets, or selections of samples with an enhanced content of jets originating from light quarks, heavy quarks or gluons are also discussed and the corresponding uncertainties are determined. © 2013 CERN for the benefit of the ATLAS collaboration
Trends in template/fragment-free protein structure prediction
Predicting the structure of a protein from its amino acid sequence is a long-standing unsolved problem in computational biology. Its solution would be of both fundamental and practical importance as the gap between the number of known sequences and the number of experimentally solved structures widens rapidly. Currently, the most successful approaches are based on fragment/template reassembly. Lacking progress in template-free structure prediction calls for novel ideas and approaches. This article reviews trends in the development of physical and specific knowledge-based energy functions as well as sampling techniques for fragment-free structure prediction. Recent physical- and knowledge-based studies demonstrated that it is possible to sample and predict highly accurate protein structures without borrowing native fragments from known protein structures. These emerging approaches with fully flexible sampling have the potential to move the field forward
Impact of jet-production data on the next-to-next-to-leading-order determination of HERAPDF2.0 parton distributions
The HERAPDF2.0 ensemble of parton distribution functions (PDFs) was introduced in 2015. The final stage is presented, a next-to-next-to-leading-order (NNLO) analysis of the HERA data on inclusive deep inelastic ep scattering together with jet data as published by the H1 and ZEUS collaborations. A perturbative QCD fit, simultaneously of αs(M2Z) and the PDFs, was performed with the result αs(M2Z)=0.1156±0.0011 (exp) +0.0001−0.0002 (model +parameterisation) ±0.0029 (scale). The PDF sets of HERAPDF2.0Jets NNLO were determined with separate fits using two fixed values of αs(M2Z), αs(M2Z)=0.1155 and 0.118, since the latter value was already chosen for the published HERAPDF2.0 NNLO analysis based on HERA inclusive DIS data only. The different sets of PDFs are presented, evaluated and compared. The consistency of the PDFs determined with and without the jet data demonstrates the consistency of HERA inclusive and jet-production cross-section data. The inclusion of the jet data reduced the uncertainty on the gluon PDF. Predictions based on the PDFs of HERAPDF2.0Jets NNLO give an excellent description of the jet-production data used as input
Centrality and transverse momentum dependence of D-0-meson production at mid-rapidity in Au plus Au collisions ats root S-NN=200 GeV
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