Search results for "Eigenvector"

showing 10 items of 303 documents

Extension of the Launay Quantum Reactive Scattering Code and Direct Computation of Time Delays.

2019

Scattering computations, particularly within the realm of molecular physics, have seen an increase in study since the development of powerful quantum methods. These dynamical processes can be analyzed via (among other quantities) the duration of the collision process and the lifetime of the intermediate complex. We use the Smith matrix Q = -iℏS†dS/dE calculated from the scattering matrix S and its derivative with respect to the total energy. Its real part contains the state-to-state time delays, and its eigenvalues give the lifetimes of the metastable states [ Smith Phys. Rev. 1960 , 118 , 349 - 356 ]. We propose an extension of the Launay HYP3D code [ Launay and Le Dourneuf Chem. Phys. Let…

Physics010304 chemical physicsScattering01 natural sciencesComputer Science ApplicationsEnergy derivativeMatrix (mathematics)Total angular momentum quantum numberQuantum mechanicsMetastability0103 physical sciencesNumerical differentiationPhysical and Theoretical ChemistryQuantumEigenvalues and eigenvectorsJournal of chemical theory and computation
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Solution for an arbitrary number of coupled identical oscillators.

1992

We propose a solution to the problem of solving the Schr\"odinger equation for an arbitrary number of identical one-dimensional harmonically coupled oscillators raised by Fan Hong-yi [Phys. Rev. A 42, 4377 (1990)]. The relationship between the Fock spaces associated with the uncoupled and coupled oscillators is given as well as the coordinate representation of the eigenstates. In view of further applications, the Lie algebraic properties of the model are examined, and the generalization to three spatial dimensions is made.

PhysicsAlgebraic propertiesGeneralizationAtomic and Molecular Physics and OpticsFock spaceSchrödinger equationsymbols.namesakeQuantum mechanicsLie algebrasymbolsRepresentation (mathematics)Eigenvalues and eigenvectorsMathematical physicsThree dimensional modelPhysical review. A, Atomic, molecular, and optical physics
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Preparation of macroscopically distinguishable superpositions of circular or linear oscillatory states of a bidimensionally trapped ion

2000

A simple scheme for the generation of two different classes of bidimensional vibrational Schrodinger cat-like states of an isotropically trapped ion is presented. We show that by appropriately adjusting an easily controllable parameter having a clear physical meaning, the states prepared by our procedure are quantum superpositions of either vibrational axial angular momentum eigenstates or Fock states along two orthogonal directions.

PhysicsAngular momentumsymbols.namesakeSuperposition principleSimple (abstract algebra)Quantum mechanicssymbolsQuantumAtomic and Molecular Physics and OpticsEigenvalues and eigenvectorsSchrödinger's catIonFock spaceJournal of Modern Optics
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A nonlinear eigenvalue problem for the periodic scalar p-Laplacian

2014

We study a parametric nonlinear periodic problem driven by the scalar $p$-Laplacian. We show that if $\hat \lambda_1 >0$ is the first eigenvalue of the periodic scalar $p$-Laplacian and $\lambda> \hat \lambda_1$, then the problem has at least three nontrivial solutions one positive, one negative and the third nodal. Our approach is variational together with suitable truncation, perturbation and comparison techniques.

PhysicsApplied MathematicsScalar (mathematics)AnalysiGeneral MedicineMathematics::Spectral TheoryLambdaSecond deformation theoremParametric equationNonlinear systemp-LaplacianConstant sign and nodal solutionExtremal solutionDivide-and-conquer eigenvalue algorithmParametric equationAnalysisEigenvalues and eigenvectorsParametric statisticsMathematical physics
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Prediction of quantum many-body chaos in protactinium atom

2017

Energy level spectrum of protactinium atom (Pa, Z=91) is simulated with a CI calculation. Levels belonging to the separate manifolds of a given total angular momentum and parity $J^\pi$ exhibit distinct properties of many-body quantum chaos. Moreover, an extremely strong enhancement of small perturbations takes place. As an example, effective three-electron interaction is investigated and found to play a significant role in the system. Chaotic properties of the eigenstates allow one to develop a statistical theory and predict probabilities of different processes in chaotic systems.

PhysicsAtomic Physics (physics.atom-ph)010308 nuclear & particles physicsChaoticFOS: Physical sciencesParity (physics)Configuration interaction01 natural sciencesQuantum chaosPhysics - Atomic PhysicsTotal angular momentum quantum numberQuantum mechanics0103 physical sciencesStatistical theory010306 general physicsQuantumEigenvalues and eigenvectors
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Can coupled-cluster theory treat conical intersections?

2007

Conical intersections between electronic states are of great importance for the understanding of radiationless ultrafast relaxation processes. In particular, accidental degeneracies of hypersurfaces, i.e., between states of the same symmetry, become increasingly relevant for larger molecular systems. Coupled-cluster theory, including both single and multireference based schemes, offers a size-extensive description of the electronic wave function, but it sacrifices the Hermitian character of the theory. In this contribution, we examine the consequences of anti-Hermitian contributions to the coupling matrix element between near-degenerate states such as linear dependent eigenvectors and compl…

PhysicsClassical mechanicsCoupled clusterGeneral Physics and AstronomyConical surfacePhysical and Theoretical ChemistryConical intersectionWave functionHermitian matrixPotential energyEigenvalues and eigenvectorsSymmetry (physics)The Journal of Chemical Physics
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The band structure of double excited states for a linear chain

2000

Abstract The energy band structure in the case of double excited states of finite spin systems (s= 1 2 ) has been investigated. A geometrical construction based on the Bethe Ansatz method for determining eigenstates has been proposed. The formula for energy spectrum in the center and at the border of Brillouin zone has been obtained. Classification of energy bands has been elaborated on and approximated dispersion law for bounded states given. Some problems with application of the Bethe Ansatz in the case of finite system has been pointed out.

PhysicsCondensed Matter PhysicsElectronic Optical and Magnetic MaterialsBethe ansatzBrillouin zoneQuantum mechanicsBounded functionExcited stateQuantum electrodynamicsDispersion relationElectrical and Electronic EngineeringElectronic band structureEigenvalues and eigenvectorsSpin-½Physica B: Condensed Matter
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An algebraic approach to the Tavis-Cummings problem

2002

An algebraic method is introduced for an analytical solution of the eigenvalue problem of the Tavis-Cummings (TC) Hamiltonian, based on polynomially deformed su(2), i.e. su_n(2), algebras. In this method the eigenvalue problem is solved in terms of a specific perturbation theory, developed here up to third order. Generalization to the N-atom case of the Rabi frequency and dressed states is also provided. A remarkable enhancement of spontaneous emission of N atoms in a resonator is found to result from collective effects.

PhysicsCondensed Matter::Quantum GasesQuantum PhysicsFOS: Physical sciencesAtomic and Molecular Physics and Opticssymbols.namesakeResonatorThird orderQuantum mechanicssymbolsSpontaneous emissionPhysics::Atomic PhysicsAlgebraic numberHamiltonian (quantum mechanics)Algebraic methodQuantum Physics (quant-ph)Eigenvalues and eigenvectorsRabi frequency
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Anyons and transmutation of statistics via vacuum induced Berry phase

2004

We show that bosonic fields may present anyonic behavior when interacting with a fermion in a Jaynes-Cummings-like model. The proposal is accomplished via the interaction of a two-level system with two quantized modes of a harmonic oscillator; under suitable conditions, the system acquires a fractional geometric phase. A crucial role is played by the entanglement of the system eigenstates, which provides a two-dimensional confinement in the effective evolution of the system, leading to the anyonic behavior. For a particular choice of parameters, we show that it is possible to transmute the statistics of the system continually from fermions to bosons. We also present an experimental proposal…

PhysicsCondensed Matter::Quantum GasesQuantum PhysicsNuclear transmutationFOS: Physical sciencesQuantum PhysicsFermionQuantum entanglementTopological quantum computerAtomic and Molecular Physics and OpticsBosonic excitationHigh Energy Physics::TheoryGeometric phaseQuantum mechanicsStatisticsAnyonQuantum Physics (quant-ph)Harmonic oscillatorEigenvalues and eigenvectorsBoson
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Multifractal electronic wave functions in disordered systems

1992

Abstract To investigate the electronic states in disordered samples we diagonalize very large secular matrices corresponding to the Anderson Hamiltonian. The resulting probability density of single electronic eigenstates in 1-, 2-, and 3-dimensional samples is analysed by means of a box-counting procedure. By linear regression we obtain the Lipschitz-Holder exponents and the corresponding singularity spectrum, typical for a multifractal set in each case. By means of a Legendre transformation the mass exponents and the generalized dimensions are derived. Consequences for spectroscopic intensities and transport properties are discussed.

PhysicsCondensed matter physicsBiophysicsProbability density functionGeneral ChemistryMultifractal systemCondensed Matter PhysicsBiochemistryAtomic and Molecular Physics and OpticsLegendre transformationsymbols.namesakeLinear regressionsymbolsSingularity spectrumWave functionHamiltonian (quantum mechanics)Eigenvalues and eigenvectorsMathematical physicsJournal of Luminescence
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