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Recent variational studies have demonstrated that the strongly correlated ground states of the fractional quantum Hall (FQH) effect can be captured using machine learning approaches starting from no prior knowledge of the underlying…
The phaseless auxiliary-field quantum Monte Carlo (ph-AFQMC) method is a stochastic imaginary-time projection technique for computing ground-state properties of strongly correlated quantum systems, with accuracy that depends critically on…
Within the context of Hartree-Fock-Bogoliubov theory, we study the behavior of superfluid Fermi systems when they pass from a small to a large container. Such systems can be now realized thanks to recent progress in experimental techniques.…
Understanding the behavior of fermion-antifermion (\(f\overline{f}\)) pairs is crucial in modern physics. These systems, governed by fundamental forces, exhibit complex interactions essential for particle physics, high-energy physics,…
We propose a novel wave function partitioning method that integrates deep-learning variational Monte Carlo with ans\"atze based on generalized product functions. This approach effectively separates electronic wave functions (WFs) into…
Fermionic cold atoms in optical traps provide viable quantum simulators of correlation effects in electronic systems. For dressed Rydberg atoms in two-dimensional traps with out-of-plane dipole moments, a realistic model of the pairwise…
We offer a new proposal for the Monte Carlo treatment of many-fermion systems in continuous space. It is based upon Diffusion Monte Carlo with significant modifications: correlated pairs of random walkers that carry opposite signs;…
We present a formulation of the Constrained Path Monte Carlo (CPMC) method for fermions that uses trial wave-functions that include many-body effects. This new formulation allows us to implement a whole family of generalized mean-field…
Determinant quantum Monte Carlo (DQMC), formulated in complex-fermion representation, has played a key role in studying strongly-correlated fermion systems. However, its applicability is limited due to the requirement of particle-number…
Ab initio calculations play an essential role in our fundamental understanding of quantum many-body systems across many subfields, from strongly correlated fermions to quantum chemistry and from atomic and molecular systems to nuclear…
A framework for developing new approximate electronic structure methods is presented, in which the correlation energy of a many-electron system in the ground state is computed as in the single-reference second-order many-body perturbation…
We propose a variational wavefunction containing parameters to tune the probabilities of all the possible onsite configurations for the periodic Anderson model. We call it the full onsite-correlation wavefunction (FOWF). This is a simple…
In this letter we present a new expression for the overlaps of wavefunctions in Hartree-Fock-Bogoliubov based theories. Starting from the Pfaffian formula by Bertsch et al (Phys. Rev. Lett. 108,042505 (2012)), an exact and computationally…
Wavefunction correction scheme, which was developed as a variance reduction tool for the pure and fixed-node diffusion Monte Carlo (DMC) computations by Anderson and Freihaut, is applied to the DMC computations of fermions without using the…
We study the correlation functions of the Pfaffian Schur process. Borodin and Rains [J. Stat. Phys. 121 (2005), 291-317] introduced the Pfaffian Schur process and derived its correlation functions using a Pfaffian analogue of the…
In this paper we analyze a recently proposed approach for the construction of antisymmetric functions for atomic and molecular systems. It is based on the assumption that the main problems with Hartree-Fock wavefunctions stem from their…
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…
Several technical aspects concerning the evaluation of the overlap between two mean field wave functions of the Hartree Fock Bogoliubov type, are discussed. The limit when several orbitals become fully occupied is derived as well as the…
We explore different ways of incorporating accurate trial wave functions into free projection auxiliary field quantum Monte Carlo (fp-AFQMC). Trial states employed include coupled cluster singles and doubles, multi-Slater, and symmetry…
$f$-electron systems exhibit a subtle interplay between strong spin--orbit coupling and crystal-field effects, producing complex energy landscapes that are computationally demanding. We introduce auxiliary functions, constructed by…