Related papers: Symmetry-based perturbation theory for electronic …
A simple theory for the leading-order correction g_1(r) to the structure of a hard-sphere liquid with discrete (e.g. square-well) potential perturbations is proposed. The theory makes use of a general approximation that effectively…
Recent developments of Perturbation Theory (PT), specifically the Effective Field Theory of Large Scale Structure (EFTofLSS) and its equivalents, have proven powerful in analyzing galaxy clustering statistics such as the galaxy power…
A new method to work out the Hermitian correspondence of a PT-symmetric quantum mechanical Hamiltonian is proposed. In contrast to the conventional method, the new method ends with a local Hamiltonian of the form p^2/2+m^2x^2/2+v(x) without…
We present a novel input scheme for general second-quantized Hamiltonians of relativistic or non-relativistic many-fermion systems. This input scheme incorporates the fermionic anticommutation relations, particle number variations, and…
We propose a framework for the connection between local symmetries of discrete Hamiltonians and the design of compact localized states. Such compact localized states are used for the creation of tunable, local symmetry-induced bound states…
We study the bispectrum in Lagrangian perturbation theory. Extending past results for the power spectrum, we describe a method to efficiently compute the bispectrum in LPT, focusing on the Zeldovich approximation, in which contributions due…
One-dimensional scattering mediated by non-Hermitian Hamiltonians is studied. A schematic set of models is used which simulate two point interactions at a variable strength and distance. The feasibility of the exact construction of the…
Coupled cluster methods are widely regarded as the gold standard of computational quantum chemistry as they are perceived to offer the best compromise between computational cost and a high-accuracy resolution of the ground state eigenvalue…
Many areas of chemistry are devoted to the challenge of understanding, predicting, and controlling the behavior of strongly localized electrons. Examples include molecular magnetism and luminescence, color centers in crystals,…
A re-formulated, non-Hermitian version of the Witten's supersymmetric quantum mechanics is presented. Its use of pseudo-Hermitian (so called PT symmetric) Hamiltonians is reviewed and illustrated via several forms of an innovated…
Quantum-selected configuration interaction (QSCI) is an approach for quantum chemical calculations using current quantum computers. In conventional QSCI, Slater determinants used for the wave function expansion are sampled by iteratively…
Quantum computing opens up new possibilities for the simulation of many-body nuclear systems. As the number of particles in a many-body system increases, the size of the space if the associated Hamiltonian increases exponentially. This…
Starting from realistic nuclear forces, the chiral N$^3$LO and JISP16, we have applied many-body perturbation theory (MBPT) to the structure of closed-shell nuclei, $^4$He and $^{16}$O. The two-body N$^3$LO interaction is softened by a…
Within density-functional theory, perturbation theory~(PT) is the state-of-the-art formalism for assessing the response to homogeneous electric fields and the associated material properties, e.g., polarizabilities, dielectric constants, and…
We present the AMBiT software package for general atomic structure calculations. This software implements particle-hole configuration interaction with many-body perturbation theory (CI+MBPT) for fully relativistic calculations of atomic…
Quantum computing has the potential to significantly speed up complex computational tasks, and arguably the most promising application area for near-term quantum computers is the simulation of quantum mechanics. To make the most of our…
The Schrieffer-Wolff transformation (SWT) is a foundational perturbative method for deriving effective Hamiltonians in quantum systems by systematically eliminating couplings between pairs of energy distant subspaces. Despite recent…
The Suzuki-Trotter decomposition, which digitalizes quantum time evolution, provides a promising framework for simulating quantum dynamics on quantum hardware and exploring quantum advantage over classical computation. However, conventional…
As physical implementations of quantum architectures emerge, it is increasingly important to consider the cost of algorithms for practical connectivities between qubits. We show that by using an arrangement of gates that we term the…
In recent years many-body perturbation theory encountered a renaissance in the field of ab initio nuclear structure theory. In various applications it was shown that perturbation theory, including novel flavors of it, constitutes a useful…