Related papers: The effect of quantization on the FCIQMC sign prob…
The fermion sign problem remains the primary obstacle in simulating the thermodynamic properties of various fermionic systems. In this work, we present a sign-blocking method to mitigate the numerical instability inherent in the sign…
We present a guiding principle for designing fermionic Hamiltonians and quantum Monte Carlo (QMC) methods that are free from the infamous sign problem by exploiting the Lie groups and Lie algebras that appear naturally in the Monte Carlo…
Generalized PT symmetry provides crucial insight into the sign problem for two classes of models. In the case of quantum statistical models at non-zero chemical potential, the free energy density is directly related to the ground state…
The absence of negative sign problem in quantum Monte Carlo simulations of spin and fermion systems has different origins. World-line based algorithms for spins require positivity of matrix elements whereas auxiliary field approaches for…
Quantum many-body systems whose Hamiltonians are non-stoquastic, i.e., have positive off-diagonal matrix elements in a given basis, are known to pose severe limitations on the efficiency of Quantum Monte Carlo algorithms designed to…
Quantum Monte Carlo (QMC) methods are the gold standard for studying equilibrium properties of quantum many-body systems -- their phase transitions, ground and thermal state properties. However, in many interesting situations QMC methods…
The quantum theory of antiferromagnetism in metals is necessary for our understanding of numerous intermetallic compounds of widespread interest. In these systems, a quantum critical point emerges as external parameters (such as chemical…
We argue the sign problem of the fermion determinant at finite density. It is unavoidable not only in Monte-Carlo simulations on the lattice but in the mean-field approximation as well. A simple model deriving from Quantum Chromodynamics…
Quantum computation of the energy of molecules and materials is one of the most promising applications of fault-tolerant quantum computers. Practical applications require development of quantum algorithms with reduced resource requirements.…
We show here that a direct application of resummation-based quantum Monte Carlo (QMC) -- implemented recently for sign-problem-free SU(2)-symmetric Hamiltonians in the stochastic series expansion (SSE) framework -- does not reduce the sign…
We present a solution to the sign problem in a class of particle-hole symmetric Hamiltonian lattice fermion models on bipartite lattices using the idea of fermion bags. The solution remains valid when the particle-hole symmetry is broken…
We show that Full Configuration Interaction Quantum Monte Carlo (FCIQMC) is a Markov Chain in its present form. We construct the Markov matrix of FCIQMC for a two determinant system and hence compute the stationary distribution. These…
The effect of the complex phase of the fermion determinant is a key question related to the sign problem in finite-density QCD. Recently it has been shown that ignoring the complex phase -- the phase quenching -- does not change physics in…
As an intrinsically-unbiased approach, quantum Monte Carlo (QMC) is of vital importance in understanding correlated phases of matter. Unfortunately, it often suffers notorious sign problem when simulating interacting fermion models. Here,…
It is believed that not all quantum systems can be simulated efficiently using classical computational resources. This notion is supported by the fact that in quantum Monte Carlo (QMC) simulations for a large number of important problems it…
Although stoquastic Hamiltonians are known to be simulable via sign-problem-free quantum Monte Carlo (QMC) techniques, the non-stoquasticity of a Hamiltonian does not necessarily imply the existence of a QMC sign problem. We give a…
Quantum Monte Carlo simulations, while being efficient for bosons, suffer from the "negative sign problem'' when applied to fermions - causing an exponential increase of the computing time with the number of particles. A polynomial time…
This work shows that the recently discovered operator contraction identity for solving the discreet Path Integral of the harmonic oscillator can be applied equally to fermions in any dimension. This then yields an exactly solvable model for…
We extend the scope of full configuration interaction quantum Monte Carlo (FCIQMC) to be applied to coupled fermion-boson hamiltonians, alleviating the a priori truncation in boson occupation which is necessary for many other wave function…
Quantum Monte Carlo methods are sophisticated numerical techniques for simulating interacting quantum systems. In some cases, however, they suffer from the notorious "sign problem" and become too inefficient to be useful. A recent…