scholarly journals Entanglement in the second quantization formalism

Open Physics ◽  
2003 ◽  
Vol 1 (2) ◽  
Author(s):  
Vlatko Vedral
Keyword(s):  
Degrees Of Freedom ◽  
Bose Condensation ◽  
Unruh Effect ◽  
Correlated Electrons ◽  
Second Quantization ◽  
Bipartite Entanglement ◽  
Entanglement Of Formation ◽  
Quantization Formalism ◽  
Internal Degrees Of Freedom ◽  
Number Of Particles

AbstractWe study properties of entangled systems in the (mainly non-relativistic) second quantization formalism. This is then applied to interacting and non-interacting bosons and fermions and the differences between the two are discussed. We present a general formalism to show how entanglement changes with the change of modes of the system. This is illustrated with examples such as the Bose condensation and the Unruh effect. It is then shown that a non-interacting collection of fermions at zero temperature can be entangled in spin, providing that their distances do not exceed the inverse Fermi wavenumber. Beyond this distance all bipartite entanglement vanishes, although classical correlations still persist. We compute the entanglement of formation as well as the mutual information for two spin-correlated electrons as a function of their distance. The analogous, non-interacting collection of bosons displays no entanglement in the internal degrees of freedom. We show how to generalize our analysis of the entanglement in the internal degrees of freedom to an arbitrary number of particles.

scholarly journals Vacuum and Spacetime Signature in the Theory of Superalgebraic Spinors

Universe ◽  
2019 ◽  
Vol 5 (7) ◽  
pp. 162 ◽  
Author(s):  
Vadim Monakhov
Keyword(s):  
Degrees Of Freedom ◽  
Vacuum State ◽  
Second Quantization ◽  
New Formalism ◽  
Gauge Transformations ◽  
Dimensional Spacetime ◽  
Internal Degrees Of Freedom ◽  
Natural Way ◽  
Number Of Particles

A new formalism involving spinors in theories of spacetime and vacuum is presented. It is based on a superalgebraic formulation of the theory of algebraic spinors. New algebraic structures playing role of Dirac matrices are constructed on the basis of Grassmann variables, which we call gamma operators. Various field theory constructions are defined with use of these structures. We derive formulas for the vacuum state vector. Five operator analogs of five Dirac gamma matrices exist in the superalgebraic approach as well as two additional operator analogs of gamma matrices, which are absent in the theory of Dirac spinors. We prove that there is a relationship between gamma operators and the most important physical operators of the second quantization method: number of particles, energy–momentum and electric charge operators. In addition to them, a series of similar operators are constructed from the creation and annihilation operators, which are Lorentz-invariant analogs of Dirac matrices. However, their physical meaning is not yet clear. We prove that the condition for the existence of spinor vacuum imposes restrictions on possible variants of the signature of the four-dimensional spacetime. It can only be (1, − 1 , − 1 , − 1 ), and there are two additional axes corresponding to the inner space of the spinor, with a signature ( − 1 , − 1 ). Developed mathematical formalism allows one to obtain the second quantization operators in a natural way. Gauge transformations arise due to existence of internal degrees of freedom of superalgebraic spinors. These degrees of freedom lead to existence of nontrivial affine connections. Proposed approach opens perspectives for constructing a theory in which the properties of spacetime have the same algebraic nature as the momentum, electromagnetic field and other quantum fields.

Integrable Model of Interacting Fermions Confined by the Morse Potential

1997 ◽  
Vol 12 (01) ◽  
pp. 195-200 ◽  
Author(s):  
V. I. Inozemtsev
Keyword(s):  
Ground State ◽  
Morse Potential ◽  
Degrees Of Freedom ◽  
Integrable Model ◽  
Quantum Systems ◽  
Pairwise Interaction ◽  
Integrals Of Motion ◽  
Arbitrary Strength ◽  
Internal Degrees Of Freedom ◽  
Number Of Particles

The integrals of motion are constructed for the Sutherland hyperbolic quantum systems of particles with internal degrees of freedom (su(n) spins) interacting with an external field with the Morse potential of an arbitrary strength τ2. These systems are confined if some constraint is imposed on τ, the strength λ of the pairwise interaction and the number of particles. The ground state is described by the wave function of the Jastrow form.

Reversibly Sampling Conformations and Binding Modes Using Molecular Darting

2020 ◽  
Author(s):  
Samuel C. Gill ◽  
David Mobley
Keyword(s):  
Monte Carlo ◽  
Ligand Binding ◽  
Binding Sites ◽  
Degrees Of Freedom ◽  
Dynamics Simulation ◽  
Hiv Integrase ◽  
Binding Modes ◽  
System A ◽  
Multiple Binding ◽  
Internal Degrees Of Freedom

<div>Sampling multiple binding modes of a ligand in a single molecular dynamics simulation is difficult. A given ligand may have many internal degrees of freedom, along with many different ways it might orient itself a binding site or across several binding sites, all of which might be separated by large energy barriers. We have developed a novel Monte Carlo move called Molecular Darting (MolDarting) to reversibly sample between predefined binding modes of a ligand. Here, we couple this with nonequilibrium candidate Monte Carlo (NCMC) to improve acceptance of moves.</div><div>We apply this technique to a simple dipeptide system, a ligand binding to T4 Lysozyme L99A, and ligand binding to HIV integrase in order to test this new method. We observe significant increases in acceptance compared to uniformly sampling the internal, and rotational/translational degrees of freedom in these systems.</div>

scholarly journals A novel class of translationally invariant spin chains with long-range interactions

2020 ◽  
Vol 2020 (8) ◽  
Author(s):  
B. Basu-Mallick ◽  
F. Finkel ◽  
A. González-López
Keyword(s):  
Long Range ◽  
Degrees Of Freedom ◽  
Spin Chains ◽  
Open Chain ◽  
New Class ◽  
Spin Interactions ◽  
Long Range Interactions ◽  
Spin Reversal ◽  
Twisted Yangian ◽  
Internal Degrees Of Freedom

Abstract We introduce a new class of open, translationally invariant spin chains with long-range interactions depending on both spin permutation and (polarized) spin reversal operators, which includes the Haldane-Shastry chain as a particular degenerate case. The new class is characterized by the fact that the Hamiltonian is invariant under “twisted” translations, combining an ordinary translation with a spin flip at one end of the chain. It includes a remarkable model with elliptic spin-spin interactions, smoothly interpolating between the XXX Heisenberg model with anti-periodic boundary conditions and a new open chain with sites uniformly spaced on a half-circle and interactions inversely proportional to the square of the distance between the spins. We are able to compute in closed form the partition function of the latter chain, thereby obtaining a complete description of its spectrum in terms of a pair of independent su(1|1) and su(m/2) motifs when the number m of internal degrees of freedom is even. This implies that the even m model is invariant under the direct sum of the Yangians Y (gl(1|1)) and Y (gl(0|m/2)). We also analyze several statistical properties of the new chain’s spectrum. In particular, we show that it is highly degenerate, which strongly suggests the existence of an underlying (twisted) Yangian symmetry also for odd m.

scholarly journals Dissipative dynamics of a particle coupled to a field via internal degrees of freedom

2021 ◽  
Vol 103 (5) ◽  
Author(s):  
Kanupriya Sinha ◽  
Adrián Ezequiel Rubio López ◽  
Yiğit Subaşı
Keyword(s):  
Degrees Of Freedom ◽  
Dissipative Dynamics ◽  
Internal Degrees Of Freedom

scholarly journals Optimal Relabeling of Water Molecules and Single-Molecule Entropy Estimation

Biophysica ◽  
2021 ◽  
Vol 1 (3) ◽  
pp. 279-296
Author(s):  
Federico Fogolari ◽  
Gennaro Esposito
Keyword(s):  
Single Molecule ◽  
Degrees Of Freedom ◽  
Water Molecules ◽  
Maximum Information ◽  
Nearest Neighbours ◽  
Biomolecular Simulations ◽  
Solvent Molecules ◽  
Solvation Entropy ◽  
Dynamics Simulations ◽  
Internal Degrees Of Freedom

Estimation of solvent entropy from equilibrium molecular dynamics simulations is a long-standing problem in statistical mechanics. In recent years, methods that estimate entropy using k-th nearest neighbours (kNN) have been applied to internal degrees of freedom in biomolecular simulations, and for the rigorous computation of positional-orientational entropy of one and two molecules. The mutual information expansion (MIE) and the maximum information spanning tree (MIST) methods were proposed and used to deal with a large number of non-independent degrees of freedom, providing estimates or bounds on the global entropy, thus complementing the kNN method. The application of the combination of such methods to solvent molecules appears problematic because of the indistinguishability of molecules and of their symmetric parts. All indistiguishable molecules span the same global conformational volume, making application of MIE and MIST methods difficult. Here, we address the problem of indistinguishability by relabeling water molecules in such a way that each water molecule spans only a local region throughout the simulation. Then, we work out approximations and show how to compute the single-molecule entropy for the system of relabeled molecules. The results suggest that relabeling water molecules is promising for computation of solvation entropy.

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