Search results for "orbit [binary]"

showing 10 items of 37 documents

Closed-shell coupled-cluster theory with spin-orbit coupling

2008

A two-component closed-shell coupled-cluster (CC) approach using relativistic effective core potentials with spin-orbit coupling included in the post-Hartree-Fock treatment is proposed and implemented at the CC singles and doubles (CCSD) level as well as at the CCSD level augmented by a perturbative treatment of triple excitations [CCSD(T)]. The latter invokes as an additional approximation the neglect of the occupied-occupied and virtual-virtual blocks of the spin-orbit coupling matrix in order to avoid the iterative N(7) steps in the treatment of triple excitations. The computational effort of the implemented two-component CC methods is about 10-15 times that of its corresponding nonrelat…

PhysicsCouplingCoupled clusterField (physics)Quantum electrodynamicsGeneral Physics and AstronomyMolecular orbitalPerturbation theory (quantum mechanics)Spin–orbit interactionPhysical and Theoretical ChemistryTriplet stateOpen shellThe Journal of Chemical Physics
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Energy-level repulsion by spin-orbit coupling in two-dimensional Rydberg excitons

2018

We study the effects of Rashba spin-orbit coupling on two-dimensional Rydberg exciton systems. Using analytical and numerical arguments we demonstrate that this coupling considerably modifies the wave functions and leads to a level repulsion that results in a deviation from the Poissonian statistics of the adjacent level distance distribution. This signifies the crossover to non-integrability of the system and hints on the possibility of quantum chaos emerging. Such a behavior strongly differs from the classical realization, where spin-orbit coupling produces highly entangled, chaotic electron trajectories in an exciton. We also calculate the oscillator strengths and show that randomization…

PhysicsCouplingLevel repulsionCondensed Matter - Mesoscale and Nanoscale PhysicsExcitonHYDROGEN-ATOMFOS: Physical sciences02 engineering and technologyElectronSpin–orbit interaction021001 nanoscience & nanotechnology01 natural sciencesQuantum chaossymbols.namesakeQUANTUM CHAOSGASQuantum mechanicsMesoscale and Nanoscale Physics (cond-mat.mes-hall)0103 physical sciencesRydberg formulasymbols010306 general physics0210 nano-technologyRealization (systems)Physical Review B
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Analytic energy gradients in closed-shell coupled-cluster theory with spin-orbit coupling

2008

Gradients in closed-shell coupled-cluster (CC) theory with spin-orbit coupling included in the post Hartree-Fock treatment have been implemented at the CC singles and doubles (CCSD) level and at the CCSD level augmented by a perturbative treatment of triple excitations [CCSD(T)]. The additional computational effort required in analytic energy-gradient calculations is roughly the same as that for ground-state energy calculations in the case of CCSD, and it is about twice in the case of CCSD(T) calculations. The structures, harmonic frequencies, and dipole moments of some heavy-element compounds have been calculated using the present analytic energy-gradient techniques including spin-orbit co…

PhysicsCouplingStructure (category theory)General Physics and AstronomySpin–orbit interactionDipoleCoupled clusterQuantum electrodynamicsPhysics::Atomic and Molecular ClustersHarmonicPhysics::Chemical PhysicsPhysical and Theoretical ChemistryAtomic physicsOpen shellHyperfine structureThe Journal of Chemical Physics
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Giant Negative Magnetoresistance Driven by Spin-Orbit Coupling at theLaAlO3/SrTiO3Interface

2015

The LaAlO3=SrTiO3 interface hosts a two-dimensional electron system that is unusually sensitive to the application of an in-plane magnetic field. Low-temperature experiments have revealed a giant negative magnetoresistance (dropping by 70%), attributed to a magnetic-field induced transition between interacting phases of conduction electrons with Kondo-screened magnetic impurities. Here we report on experiments over a broad temperature range, showing the persistence of the magnetoresistance up to the 20 K range—indicative of a single-particle mechanism. Motivated by a striking correspondence between the temperature and carrier density dependence of our magnetoresistance measurements we propo…

PhysicsElectron densityColossal magnetoresistanceCondensed matter physicsMagnetoresistanceScatteringGeneral Physics and AstronomySpin–orbit interactionElectronAtmospheric temperature rangeCondensed Matter::Mesoscopic Systems and Quantum Hall EffectMagnetic fieldCondensed Matter::Materials ScienceCondensed Matter::Strongly Correlated ElectronsPhysical Review Letters
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Spin-orbit interaction in bremsstrahlung and its effect on the electron motion in a strong Coulomb field

2015

Linear polarization of bremsstrahlung x rays produced in collisions of longitudinally polarized 2.1-MeV electrons with gold atoms was studied using the Compton scattering technique. We observed that the angle of x-ray polarization is strongly correlated with the incoming electron polarization. This correlation reveals the dominance of the spin-orbit interaction in bremsstrahlung and indicates a striking effect of the electron spin on the electron motion in a strong Coulomb field. The results confirm the validity of the theoretical predictions in a computationally challenging energy regime.

PhysicsField (physics)Linear polarizationAstrophysics::High Energy Astrophysical PhenomenaCompton scatteringBremsstrahlungCoulombElectronSpin–orbit interactionAtomic physicsPolarization (waves)Atomic and Molecular Physics and OpticsPhysical Review A
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Baryon decuplet in the chiral dynamics of Λ hyperons in nuclear matter

2007

6 pages, 5 figures.-- PACS nrs.: 21.80.+a; 21.65.+f; 13.75.Ev; 24.10.Cn.-- ISI Article Identifier: 000245332200063.-- ArXiv pre-print available at: http://arxiv.org/abs/nucl-th/0611082

PhysicsNuclear and High Energy PhysicsParticle physicsHigh Energy Physics::LatticeMany-body theoryHigh Energy Physics::PhenomenologyNuclear TheoryHyperon[PACS] Hyperon–nucleon interactions (energy ≤ 10 GeV)FísicaSpin-orbit InteractionSpin–orbit interactionNuclear matter[PACS] Many-body theory of nucleiNuclear physicsBaryonMany-body problemFinite NucleiPionΣ-hypernucleiHigh Energy Physics::ExperimentNuclear Experiment[PACS] Nuclear matterSpin-½
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Rashba spin-orbit-interaction-based quantum pump in graphene

2012

We present a proposal for an adiabatic quantum pump based on a graphene monolayer patterned by electrostatic gates and operated in the low-energy Dirac regime. The setup under investigation works in the presence of inhomogeneous spin-orbit interactions of intrinsic- and Rashba-type and allows to generate spin polarized coherent current. A local spin polarized current is induced by the pumping mechanism assisted by the spin-double refraction phenomenon.

PhysicsPhysics and Astronomy (miscellaneous)Condensed matter physicsCondensed Matter - Mesoscale and Nanoscale PhysicsGrapheneDirac (software)FOS: Physical sciencesPhysics::OpticsSpin–orbit interactionlaw.inventionlawMonolayerMesoscale and Nanoscale Physics (cond-mat.mes-hall)Refraction (sound)Condensed Matter::Strongly Correlated ElectronsAdiabatic processQuantumSpin-½
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LIF intensity distribution as a deperturbation tool: application to the fully-mixed A1Σ+–b3Π complex of NaRb

2005

Abstract The intensity distribution in the NaRb A 1 Σ + ( v A ′ = 16 , J ′ = 30 ; v A ′ = 18 , J ′ = 66 ) ∼ b 3 Π → X 1 Σ + ( v X ′ ′ = 2 ÷ 44 , J ′ ′ = J ′ ± 1 ) fluorescence series induced by diode laser excitation from the ground state have been measured and directly applied to restore adiabatic potential energy curve for the A-state of the fully-mixed A 1 Σ + – b 3 Π complex. Relative intensities in the long non-diagonal A → X progressions have been proved to be much less influenced by strong spin–orbit interaction than the corresponding term values of the fully coupled A 1 Σ + – b 3 Π complex.

PhysicsRadiationSpin–orbit interactionLaserFluorescencePotential energyAtomic and Molecular Physics and Opticslaw.inventionlawAtomic physicsGround stateAdiabatic processLaser-induced fluorescenceSpectroscopyExcitationJournal of Quantitative Spectroscopy and Radiative Transfer
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The gas-phase chemiionization reaction between samarium and oxygen atoms: A theoretical study

2004

The Sm + O chemiionization reaction has been investigated theoretically using a method that allows for correlation and relativistic effects. Potential energy curves have been calculated for several electronic states of SmO and SmO+. Comparison with available spectroscopic and thermodynamic values for these species is reported and a mechanism for the chemiionization reaction Sm + O is proposed. The importance of spin–orbit coupling in the excited states of SmO, in allowing this chemiionization reaction to take place, has been revealed by these calculations. This paper shows the metal-plus-oxidant chemiionization reaction.

SamariumExcited statesGeneral Physics and Astronomychemistry.chemical_elementRelativistic correctionsPotential energyOxygenOxygenSamariumAtom-atom reactionsOxygen atomchemistryPotential energy surfacesExcited stateIonizationddc:540OxidationSpin-orbit interactionsPhysical and Theoretical ChemistryAtomic physicsRelativistic quantum chemistryChain reactionIonisationThe Journal of Chemical Physics
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Panel Discussion Spin and Polarization Effects in Atomic Processes

1973

In view of all the present activity on spin and polarization effects in atomic processes, perhaps the best approach to my introduction is first to summarize some of the most important recent results and to restrict myself to some typical characteristics.

Scattering cross-sectionPhysicsCondensed matter physicsSpin–orbit interactionPolarization (waves)
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