相关论文: Fast Semistochastic Heat-Bath Configuration Intera…
The presented paper concentrates on the boundary element method (BEM) for the heat equation in three spatial dimensions. In particular, we deal with tensor product space-time meshes allowing for quadrature schemes analytic in time and…
The semiclassical Schr\"odinger equation with time-dependent potentials is an important model to study electron dynamics under external controls in the mean-field picture. In this paper, we propose two multiscale finite element methods to…
In the present manuscript, approximate solution for 1D heat conduction equation will be sought with the Septic Hermite Collocation Method (SHCM). To achieve this goal, by means of the roots of both Chebyschev and Legendre polinomials used…
We formulate a finite-temperature scheme of the variational cluster approximation (VCA) particularly suitable for an exact-diagonalization cluster solver. Based on the analytical properties of the single-particle Green's function matrices,…
We present a semi-analytical approach for studying quantum thermal energy transport beyond the weak system-bath coupling regime. Our treatment, which results in a renormalized, effective Hamiltonian model is based on the reaction coordinate…
Helium atom is the simplest many-body electronic system provided by nature. The exact solution to the Schr\"odinger equation is known for helium ground and excited states, and represents a workbench for any many-body methodology. Here, we…
We outline a rigorous method which can be used to solve the many-body Schroedinger equation for a Coulomb interacting electronic system in an external classical magnetic field as well as a quantized electromagnetic field. Effects of the…
The computationally expensive evaluation and storage of high-rank reduced density matrices (RDMs) has been the bottleneck in the calculation of dynamic correlation for multireference wave functions in large active spaces. We present a…
In this article, we explore the dissipation dynamics of a strongly coupled multidimensional system in contact with a Markovian bath following a system-bath approach. We use in this endeavour the recently developed stochastic…
We introduce a novel numerical method to integrate partial differential equations representing the Hamiltonian dynamics of field theories. It is a multi-symplectic integrator that locally conserves the stress-energy tensor with an excellent…
Neutral uranium (U I) is a very difficult atom for theoretical calculations due to a large number of valence electrons, six, strong valence-valence and valence-core correlations, high density of states, and relativistic effects.…
We have proposed a cluster heat bath(CHB) method of a quasi-one dimensional Ising model and demonstrated that it reproduces the exact results of the two dimensional Ising model with axially anisotropic exchange interactions. The point of…
An accurate and efficient method dealing with the few-body dynamics is important for simulating collisional N-body systems like star clusters and to follow the formation and evolution of compact binaries. We describe such a method which…
We present a new scheme to couple existing numerical methods for elastic self-interacting dark matter (SIDM) to the hydrodynamic equations via a continuous function of the local Knudsen number. The method, an SIDM-hydro hybrid (SHH), allows…
In this work, we develop a mathematical framework for a Selected Configuration Interaction (SCI) algorithm within a bi-orthogonal basis for transcorrelated (TC) calculations. The bi-orthogonal basis used here serves as the equivalent of the…
We have devised a variational sinc collocation method (VSCM) which can be used to obtain accurate numerical solutions to many strong-coupling problems. Sinc functions with an optimal grid spacing are used to solve the linear and non-linear…
Quantum few-body systems are deceptively simple. Indeed, with the notable exception of a few special cases, their associated Schrodinger equation cannot be solved analytically for more than two particles. One has to resort to approximation…
We use the composite boson (coboson) many-body formalism to tackle scattering lengths for cold fermionic atoms. We show that bound dimers can be taken as elementary entities provided that fermion exchanges between them are treated exactly,…
Accurate atomic structure calculations of complicated atoms with 4 or more valence electrons begin to push the memory and time limits of supercomputers. This paper presents a robust method of decreasing the size of \textit{ab initio}…
Paradigmatic spin Hamiltonians in condensed matter and quantum sensing typically utilize pair-wise or 2-body interactions between constituents in the material or ensemble. However, there is growing interest in exploring more general…