A recently proposed Markov approach provides Lindblad-type scattering superoperators, which ensure the physical (positive-definite) character of the many-body density matrix. We apply the mean-field approximation to such a many-body equation, in the presence of one- and two-body scattering mechanisms, and we derive a closed equation of motion for the electronic single-particle density matrix, which turns out to be nonlinear as well as non-Lindblad. We prove that, in spite of its nonlinear and non-Lindblad structure, the mean-field approximation does preserve the positive-definite character of the single-particle density matrix, an essential prerequisite of any reliable kinetic treatment of semiconductor quantum devices. This result is in striking contrast with conventional (non-Lindblad) Markov approaches, where the single-particle mean-field equations can lead to positivity violations and thus to unphysical results. Furthermore, the proposed single-particle formulation is extended to the case of quantum systems with spatial open boundaries, providing a formal derivation of a recently proposed density-matrix treatment based on a Lindblad-like system-reservoir scattering superoperator.A recently proposed Markov approach provides Lindblad-type scattering superoperators, which ensure the physical (positive-definite) character of the many-body density matrix. We apply the mean-field approximation to such a many-body equation, in the presence of one- and two-body scattering mechanisms, and we derive a closed equation of motion for the electronic single-particle density matrix, which turns out to be nonlinear as well as non-Lindblad. We prove that, in spite of its nonlinear and non-Lindblad structure, the mean-field approximation does preserve the positive-definite character of the single-particle density matrix, an essential prerequisite of any reliable kinetic treatment of semiconductor quantum devices. This result is in striking contrast with conventional (non-Lindblad) Markov approaches, where the single-particle mean-field equations can lead to positivity violations and thus to unphysical results. Furthermore, the proposed single-particle formulation is extended to the case of quantum systems with spatial open boundaries, providing a formal derivation of a recently proposed density-matrix treatment based on a Lindblad-like system-reservoir scattering superoperator.

arXiv:1408.1898Physical Review BSep 23, 201452 citations

General Density Matrix Theory

Karl Blum

Springer series on atomic, optical, and plasma physicsOct 4, 20118 citations

Simplified Derivation of the Binary Collision Expansion and Its Connection with the Scattering Operator Expansion

A. J. F. Siegert, Ei Teramoto

The binary collision expansion for the density matrix of a system of $N$ particles with pair interaction was derived by Huang, Lee, and Yang by expansion in the interaction and subsequent summation over terms represented by certain classes of diagrams. A simpler derivation has been obtained by the use of the $\frac{N(N\ensuremath{-}1)}{2}$ integral equations which relate the density matrix of the system to the density matrices of systems in which only one pair of particles interacts. Successive substitution of the integral equations into each other yields an expansion which by a trivial additional step becomes the binary collision expansion. Our derivation shows also that the binary collision expansion is the Laplace inverse of the coordinate representation of the expansion in terms of scattering operators.The binary collision expansion for the density matrix of a system of $N$ particles with pair interaction was derived by Huang, Lee, and Yang by expansion in the interaction and subsequent summation over terms represented by certain classes of diagrams. A simpler derivation has been obtained by the use of the $\frac{N(N\ensuremath{-}1)}{2}$ integral equations which relate the density matrix of the system to the density matrices of systems in which only one pair of particles interacts. Successive substitution of the integral equations into each other yields an expansion which by a trivial additional step becomes the binary collision expansion. Our derivation shows also that the binary collision expansion is the Laplace inverse of the coordinate representation of the expansion in terms of scattering operators.

Physical ReviewJun 15, 195845 citations

Density Matrix Theory and Applications

Bernd Esser

Zeitschrift für Physikalische ChemieJan 1, 19980 citations

Refined formulation and evaluation of entanglement entropy in elastic scattering

Shigenori Seki

We are interested in the entanglement entropy of the final state of two particles in an elastic scattering. One can expect that the entanglement is yielded by the interaction between the particles. Within an S-matrix theory, by using the partial wave expansion of the S-matrix elements for two-particle states, we calculate a density matrix in a high energy elastic scattering, and obtain the entanglement entropy formula, which is described by physical observables. In the derivation of this formula, there appear divergences due to the infinite volume of two-particle Hilbert space. In order to avoid such divergences, we suggest a volume-regularization. Then we concretely evaluate the entanglement entropy for proton-proton scattering by using experimental data.We are interested in the entanglement entropy of the final state of two particles in an elastic scattering. One can expect that the entanglement is yielded by the interaction between the particles. Within an S-matrix theory, by using the partial wave expansion of the S-matrix elements for two-particle states, we calculate a density matrix in a high energy elastic scattering, and obtain the entanglement entropy formula, which is described by physical observables. In the derivation of this formula, there appear divergences due to the infinite volume of two-particle Hilbert space. In order to avoid such divergences, we suggest a volume-regularization. Then we concretely evaluate the entanglement entropy for proton-proton scattering by using experimental data.

AIP conference proceedingsJan 1, 20210 citations

The binary collision expansion for the density matrix of a system of

N

particles with pair interaction was derived by Huang, Lee, and Yang by expansion in the interaction and subsequent summation over terms represented by certain classes of diagrams. A simpler derivation has been obtained by the use of the $\frac{N(N\ensuremath{-}1)}{2}$ integral equations which relate the density matrix of the system to the density matrices of systems in which only one pair of particles interacts. Successive substitution of the integral equations into each other yields an expansion which by a trivial additional step becomes the binary collision expansion. Our derivation shows also that the binary collision expansion is the Laplace inverse of the coordinate representation of the expansion in terms of scattering operators.