Related papers: On the time evolution of fermionic occupation numb…
The Pauli exclusion principle is a constraint on the natural occupation numbers of fermionic states. It has been suspected since at least the 1970's, and only proved very recently, that there is a multitude of further constraints on these…
The concept of active spaces simplifies the description of interacting quantum many-body systems by restricting to a neighbourhood of active orbitals around the Fermi level. The respective wavefunction ansatzes which involve all possible…
Fermionic natural occupation numbers do not only obey Pauli's exclusion principle but are even stronger restricted by so-called generalized Pauli constraints. Whenever given natural occupation numbers lie on the boundary of the allowed…
The natural occupation numbers of fermionic systems are subject to non-trivial constraints, which include and extend the original Pauli principle. A recent mathematical breakthrough has clarified their mathematical structure and has opened…
All matter is made up of fermions -- one of the fundamental type of particles in nature. Fermions follow the Pauli exclusion principle, stating that two or more identical fermions cannot occupy the same quantum state. Antisymmetry of the…
Fermionic natural occupation numbers do not only obey Pauli's exclusion principle, but are even further restricted by so-called generalized Pauli constraints. Such restrictions are particularly relevant whenever they are saturated by given…
We have explained and comprehensively illustrated in Part I that the generalized Pauli constraints suggest a natural extension of the concept of active spaces. In the present Part II, we provide rigorous derivations of the theorems involved…
We study the time evolution of an atom suddenly coupled to a thermal radiation field. As a simplified model of the atom-electromagnetic field system we use a system composed by a harmonic oscillator linearly coupled to a scalar field in the…
We study the time evolution of occupation numbers for interacting Fermi-particles in the situation when exact compound states are "chaotic". This situation is generic for highly excited many-particles states in heavy nuclei, complex atoms,…
We obtain a time-evolution operator for a forced optomechanical quantum system using Lie algebraic methods when the normalized coupling between the electromagnetic field and a mechanical oscillator, $G/\omega_m$, is not negligible compared…
Postulated by Pauli to explain the electronic structure of atoms and molecules, the exclusion principle establishes an upper bound of 1 for the fermionic natural occupation numbers $\{n_i\}$. A recent analysis of the pure…
We consider the exact time-evolution of a broad class of fermionic open quantum systems with both strong interactions and strong coupling to wide-band reservoirs. We present a nontrivial fermionic duality relation between the evolution of…
Pauli's exclusion principle has a strong impact on the properties of most fermionic quantum systems. Remarkably, the fermionic exchange symmetry implies further constraints on the one-particle picture. By exploiting those generalized Pauli…
We report equations of motion for the occupation numbers of natural spin orbitals and show that adiabatic extensions of common functionals employed in ground-state reduced-density-matrix-functional theory have the shortcoming of leading…
An analytical solution for the time evolution of decay of two identical non interacting quantum particles seated initially within a potential of finite range is derived using the formalism of resonant states. It is shown that the wave…
For a quantum system of N identical, harmonically interacting particles in a one-dimensional harmonic trap we calculate for the bosonic and fermionic ground state the corresponding 1-particle reduced density operator $\rho_1$ analytically.…
A method based off of operator consideration for solving the time evolution of a wave function is developed. The method is applied to free space, constant force and harmonic oscillator potentials where general solutions are derived for the…
Understanding the real-time evolution of many-electron quantum systems is essential for studying dynamical properties in condensed matter, quantum chemistry, and complex materials, yet it poses a significant theoretical and computational…
Fermion sampling is to generate probability distribution of a many-body Slater-determinant wavefunction, which is termed "determinantal point process" in statistical analysis. For its inherently-embedded Pauli exclusion principle, its…
Open systems acquire time-dependent coupling constants through interaction with an external field or environment. We generalize the Lewis-Riesenfeld invariant theorem to open system of quantum fields after second quantization. The…