Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Log inSign up
Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Blog
Job Board
Q3AS

© 2026 Aqora Quantum S.A.S.

TermsPrivacyLegal Notice

arXiv:physics/0407110 · Journal of Physics B Atomic Molecular and Optical Physics

Dynamics of the pionium with the density matrix formalism

Leonid Afanasyev, C. Santamarina Ríos, A.V. Tarasov, O. O. Voskresenskaya

Published Dec 7, 2004• 6 citations
arXivHTMLPDF

Abstract

The evolution of pionium, the $π^+ π^-$ hydrogen-like atom, while passing through matter is solved within the density matrix formalism in the first Born approximation. We compare the influence on the pionium break-up probability between the standard probabilistic calculations and the more precise picture of the density matrix formalism accounting for interference effects. We focus our general result in the particular conditions of the DIRAC experiment at CERN.

DOI
10.1088/0953-4075/37/24/003

Related papers

Density Matrix Formalism. Resolvent Operator

Ole Keller

A detailed account of the density matrix formalism and the resolvent operator theory is given. The statistical mixture of quantum states is described in terms of the density matrix operator, a concept which in an elegant manner allows one to obtain the ensemble average of an observable [a Hermitian operator, which eigenspectrum is complete]. On the basis of an integral equation for the evolution operator, described in the Interaction Representation, the Liouville equation, describing the dynamical evolution of the density matrix operator, is established. A comprehensive analysis of thermal equilibrium in electron systems is presented. For a description of the dynamical time evolution of a system in contact with a heat bath, a reservoir in thermal equilibrium, the den- sity matrix operator approach is shown to be extremely convenient. The Kubo formalism for the time-dependent density matrix is discussed in its most general form. The so-called resolvent propagator formalism is set up starting from a discussion of the analytical part of a Dirac delta function. Having established integral equations for the retarded and advanced scalar propagator operators, the resolvent propagator concept is introduced and analyzed. The resolvent of the Hamiltonian is of particular importance in physics, and the singularities of this resolvent (poles and branch cuts) are identified. We finish by a study of correlated systems in terms of the reduced density matrix operator concept.

CRC Press eBooks•Aug 6, 2024•0 citations

Optimized expansion for density matrix

Anna Okopińska

The optimized expansion is applied to the quantum mechanical evolution amplitude, providing approximations to the density matrix and to the particle density. For the anharmonic oscillator and for the electron in the hydrogen atom the first order approximations to particle density agree well with the exact results.

AIP conference proceedings•Jan 1, 2000•0 citations

Reduced density matrix and combined dynamics of electrons and nuclei

Yang Zhao, Satoshi Yokojima, Guan-Hua Chen

Nuclear dynamics is incorporated into an efficient density matrix formalism of electronic dynamics which has been applied to molecular systems containing thousands of atoms. The formalism for the combined dynamics of electrons and nuclei is derived from the Dirac–Frenkel variational principle. The single electron reduced density matrices and the Glauber coherent states are used for the electronic and nuclear degrees of freedom, respectively. The new formalism is applicable to simulate the dynamics of large molecular systems. As an illustration of its validity, the formalism is employed to calculate the electron and nuclei dynamics of hydrogen molecules.

The Journal of Chemical Physics•Sep 8, 2000•16 citations

The Quantum Mechanical Density Operator And Its Time Evolution: Quantum Dynamics Using The Quantum Liouville Equation

Abraham Nitzan

The starting point of the classical description of motion is the Newton equations that yield a phase space trajectory (rN (t), pN (t)) for a given initial condition (rN (0), pN (0)). Alternatively one may describe classical motion in the framework of the Liouville equation (Section (1.2.2)) that describes the time evolution of the phase space probability density f (rN , pN ; t). For a closed system fully described in terms of a well specified initial condition, the two descriptions are completely equivalent. Probabilistic treatment becomes essential in reduced descriptions that focus on parts of an overall system, as was demonstrated in Sections 5.1–5.3 for equilibrium systems, and in Chapters 7 and 8 that focus on the time evolution of classical systems that interact with their thermal environments. This chapter deals with the analogous quantum mechanical problem. Within the limitations imposed by its nature as expressed, for example, by Heisenbergtype uncertainty principles, the Schrödinger equation is deterministic. Obviously it describes a deterministic evolution of the quantum mechanical wavefunction. The analog of the phase space probability density f (rN , pN ; t) is now the quantum mechanical density operator (often referred to as the “density matrix”), whose time evolution is determined by the quantum Liouville equation. Again, when the system is fully described in terms of a well specified initial wavefunction, the two descriptions are equivalent. The density operator formalism can, however, be carried over to situations where the initial state of the system is not well characterized and/or a reduced description of part of the overall system is desired. Such situations are considered later in this chapter.

Oxford University Press eBooks•Apr 6, 2006•1 citation

Quantum Theory of a Gas Laser. II

C. R. Willis

We generalize the method of deriving a kinetic equation for a gas laser developed in the first paper of this series to include radiation-matter correlations. As a consequence, we are able to show that the first Born approximation with asymptotic conditions which contain radiation-matter correlations is sufficient to explain the nonthermal photon distribution observed in photon-counting experiments. Our derivation includes the spatial and velocity effects of the motion of the gas atoms. After adiabatically eliminating the matter variables, we obtain a master equation for the radiation density matrix $R$ with nonlinear coefficients. Our radiation master equation for stationary atoms without spatial effects is the same as the generalized Fokker-Planck equation of the Langevin-noise-equation treatment of lasers. We show that the generalized Fokker-Planck equation is the result of the first-Born-approximation treatment of the j\ifmmode\cdot\else\textperiodcentered\fi{}A interaction and is not dependent upon the microscopic structure of the reservoirs. In the first Born approximation, the diagonal and off-diagonal matrix elements of $R$ do not interact with each other. Consequently, an initially diagonal radiation density matrix remains diagonal. However, we show that even though the stationary state is diagonal it is necessary to know the propagator of the off-diagonal part of $R$ to answer time-dependent questions about quantities, such as the line shape, that depend on phase.

Physical Review•Jan 10, 1968•14 citations

A realistic interpretation of the density matrix I: Basic concepts

A. Raiteri

A realistic interpretation of Schroedinger and Dirac equations for density matrices is proposed, in which the difference between the position arguments of the density matrix is considered as an objective extra space dimension. "Particle" solutions are found, which are perfectly localized both in position space and in momentum space (the position and momentum operators commute in the density matrix representation); definitions for all observable quantities are given and the values associated to the "particle" solutions are the correct ones, both for the non-relativistic and the relativistic case. Finally, a non-linear interaction (the electromagnetic one) is introduced in an attempt to single out the "particle" solutions of the Dirac equation from all other solutions; the dynamical evolution of the electromagnetic field is described by the classical (unquantized) Maxwell equations.

arXiv:quant-ph/9812011•Dec 4, 1998•1 citation
The evolution of pionium, the π+π−π^+ π^-π+π− hydrogen-like atom, while passing through matter is solved within the density matrix formalism in the first Born approximation. We compare the influence on the pionium break-up probability between the standard probabilistic calculations and the more precise picture of the density matrix formalism accounting for interference effects. We focus our general result in the particular conditions of the DIRAC experiment at CERN.
A detailed account of the density matrix formalism and the resolvent operator theory is given. The statistical mixture of quantum states is described in terms of the density matrix operator, a concept which in an elegant manner allows one to obtain the ensemble average of an observable [a Hermitian operator, which eigenspectrum is complete]. On the basis of an integral equation for the evolution operator, described in the Interaction Representation, the Liouville equation, describing the dynamical evolution of the density matrix operator, is established. A comprehensive analysis of thermal equilibrium in electron systems is presented. For a description of the dynamical time evolution of a system in contact with a heat bath, a reservoir in thermal equilibrium, the den- sity matrix operator approach is shown to be extremely convenient. The Kubo formalism for the time-dependent density matrix is discussed in its most general form. The so-called resolvent propagator formalism is set up starting from a discussion of the analytical part of a Dirac delta function. Having established integral equations for the retarded and advanced scalar propagator operators, the resolvent propagator concept is introduced and analyzed. The resolvent of the Hamiltonian is of particular importance in physics, and the singularities of this resolvent (poles and branch cuts) are identified. We finish by a study of correlated systems in terms of the reduced density matrix operator concept.
Nuclear dynamics is incorporated into an efficient density matrix formalism of electronic dynamics which has been applied to molecular systems containing thousands of atoms. The formalism for the combined dynamics of electrons and nuclei is derived from the Dirac–Frenkel variational principle. The single electron reduced density matrices and the Glauber coherent states are used for the electronic and nuclear degrees of freedom, respectively. The new formalism is applicable to simulate the dynamics of large molecular systems. As an illustration of its validity, the formalism is employed to calculate the electron and nuclei dynamics of hydrogen molecules.
The starting point of the classical description of motion is the Newton equations that yield a phase space trajectory (rN (t), pN (t)) for a given initial condition (rN (0), pN (0)). Alternatively one may describe classical motion in the framework of the Liouville equation (Section (1.2.2)) that describes the time evolution of the phase space probability density f (rN , pN ; t). For a closed system fully described in terms of a well specified initial condition, the two descriptions are completely equivalent. Probabilistic treatment becomes essential in reduced descriptions that focus on parts of an overall system, as was demonstrated in Sections 5.1–5.3 for equilibrium systems, and in Chapters 7 and 8 that focus on the time evolution of classical systems that interact with their thermal environments. This chapter deals with the analogous quantum mechanical problem. Within the limitations imposed by its nature as expressed, for example, by Heisenbergtype uncertainty principles, the Schrödinger equation is deterministic. Obviously it describes a deterministic evolution of the quantum mechanical wavefunction. The analog of the phase space probability density f (rN , pN ; t) is now the quantum mechanical density operator (often referred to as the “density matrix”), whose time evolution is determined by the quantum Liouville equation. Again, when the system is fully described in terms of a well specified initial wavefunction, the two descriptions are equivalent. The density operator formalism can, however, be carried over to situations where the initial state of the system is not well characterized and/or a reduced description of part of the overall system is desired. Such situations are considered later in this chapter.
We generalize the method of deriving a kinetic equation for a gas laser developed in the first paper of this series to include radiation-matter correlations. As a consequence, we are able to show that the first Born approximation with asymptotic conditions which contain radiation-matter correlations is sufficient to explain the nonthermal photon distribution observed in photon-counting experiments. Our derivation includes the spatial and velocity effects of the motion of the gas atoms. After adiabatically eliminating the matter variables, we obtain a master equation for the radiation density matrix RRR with nonlinear coefficients. Our radiation master equation for stationary atoms without spatial effects is the same as the generalized Fokker-Planck equation of the Langevin-noise-equation treatment of lasers. We show that the generalized Fokker-Planck equation is the result of the first-Born-approximation treatment of the j\ifmmode\cdot\else\textperiodcentered\fi{}A interaction and is not dependent upon the microscopic structure of the reservoirs. In the first Born approximation, the diagonal and off-diagonal matrix elements of RRR do not interact with each other. Consequently, an initially diagonal radiation density matrix remains diagonal. However, we show that even though the stationary state is diagonal it is necessary to know the propagator of the off-diagonal part of RRR to answer time-dependent questions about quantities, such as the line shape, that depend on phase.
A realistic interpretation of Schroedinger and Dirac equations for density matrices is proposed, in which the difference between the position arguments of the density matrix is considered as an objective extra space dimension. "Particle" solutions are found, which are perfectly localized both in position space and in momentum space (the position and momentum operators commute in the density matrix representation); definitions for all observable quantities are given and the values associated to the "particle" solutions are the correct ones, both for the non-relativistic and the relativistic case. Finally, a non-linear interaction (the electromagnetic one) is introduced in an attempt to single out the "particle" solutions of the Dirac equation from all other solutions; the dynamical evolution of the electromagnetic field is described by the classical (unquantized) Maxwell equations.