Related papers: Electronic Structure in a Fixed Basis is QMA-compl…
We construct a class of exact ground states for correlated electrons on pentagon chains in the high density region and discuss their physical properties. In this procedure the Hamiltonian is first cast in a positive semidefinite form using…
A Hartree--Fock analysis of the ground-state electronic structure of the finite spherical jellium model is carried out for systems containing up to $520$ electrons in a positive background field with densities ranging from $10^{-3}$ to $1$.…
We show that the two-dimensional (2D) local Hamiltonian problem with the constraint that the ground state obeys area laws is QMA-complete. We also prove similar results in 2D translation-invariant systems and for the 3D Heisenberg and…
We derive electronic tight-binding Hamiltonians for strained graphene, hexagonal boron nitride and transition metal dichalcogenides based on Wannier transformation of {\it ab initio} density functional theory calculations. Our microscopic…
Single particle basis functions for composite fermions are obtained from which many-composite fermion states confined to the lowest electronic Landau level can be constructed in the standard manner, i.e., by building Slater determinants.…
We derive and implement symmetry-projected Hartree-Fock-Bogoliubov (HFB) equations and apply them to the molecular electronic structure problem. All symmetries (particle number, spin, spatial, and complex conjugation) are deliberately…
The magnetic Hartree Fock ground state stability for a two-dimensional interacting electron system with Rashba-type coupling is studied by implementing the standard many body Green's function formalism. The externally applied electrical…
Ground states of local Hamiltonians can be generally highly entangled: any quantum circuit that generates them (even approximately) must be sufficiently deep to allow coupling (entanglement) between any pair of qubits. Until now this…
The Bose-Hubbard model is a system of interacting bosons that live on the vertices of a graph. The particles can move between adjacent vertices and experience a repulsive on-site interaction. The Hamiltonian is determined by a choice of…
Quantum Monte Carlo (QMC) is an advanced simulation methodology for studies of manybody quantum systems. In this review, we focus on the electronic structure QMC, i.e., methods relevant for systems described by the electron-ion…
The momentum, electronic density, spin density, and interaction dependences of the exponents that control the $(k,\omega)$-plane singular features of the $\sigma =\uparrow,\downarrow$ one-electron spectral functions of the 1D Hubbard model…
A central result in the study of Quantum Hamiltonian Complexity is that the k-Local hamiltonian problem is QMA-complete. In that problem, we must decide if the lowest eigenvalue of a Hamiltonian is bounded below some value, or above…
Finding the ground state energy of the Heisenberg Hamiltonian is an important problem in the field of condensed matter physics. In some configurations, such as the antiferromagnetic translationally-invariant case on the 2D square lattice,…
The circuit-to-Hamiltonian construction has found widespread use within the field of Hamiltonian complexity, particularly for proving QMA-hardness results. In this work we examine the ground state energies of the Hamiltonian for standard…
In this paper, we investigate a system of quantum electrodynamics with cutoffs. The total Hamiltonian is defined on a tensor product of a fermion Fock space and a boson Fock. It is shown that, under spatially localized conditions and…
The central problem in electronic structure theory is the computation of the eigenvalues of the electronic Hamiltonian -- an unbounded, self-adjoint operator acting on a Hilbert space of antisymmetric functions. Coupled cluster (CC)…
The QMA-completeness of the local Hamiltonian problem is a landmark result of the field of Hamiltonian complexity that studies the computational complexity of problems in quantum many-body physics. Since its proposal, substantial effort has…
Product states, unentangled tensor products of single qubits, are a ubiquitous ansatz in quantum computation, including for state-of-the-art Hamiltonian approximation algorithms. A natural question is whether we should expect to efficiently…
Within the framework of nonrelativisitic quantum electrodynamics we consider a single nucleus and $N$ electrons coupled to the radiation field. Since the total momentum $P$ is conserved, the Hamiltonian $H$ admits a fiber decomposition with…
Under suitable assumptions, the quantum phase estimation (QPE) algorithm is able to achieve Heisenberg-limited precision scaling in estimating the ground state energy. However, QPE requires a large number of ancilla qubits and large circuit…