Related papers: W4$\Lambda$: leveraging $\Lambda$ coupled cluster …
Numerical linked-cluster expansions allow one to calculate finite-temperature properties of quantum lattice models directly in the thermodynamic limit through exact solutions of small clusters. However, full diagonalization is often the…
We discuss a recent approach for overcoming the poor convergence of the perturbative expansion for the thermodynamic potential of QCD. This approach is based on self-consistent approximations which allow for a gauge-invariant and manifestly…
In this work we present a coupled-cluster theory for the propagation of multireference electronic systems initiating at general quantum mechanical states. Our formalism is based on the infinitesimal analysis of modified cluster operators,…
The Colebrook-White equation is the widely used basis for the calculation of the friction factor lambda for flows in pipes and ducts. Because this equation is implicit in lambda, many solutions have been developed to ease the calculation in…
We investigate the cluster size convergence of the energy and observables using two forms of density matrix embedding theory (DMET): the original cluster form (CDMET) and a new formulation motivated by the dynamical cluster approximation…
We present a time-dependent formulation of coupled cluster theory. This theory allows for direct computation of the free energy of quantum systems at finite temperature by imaginary time integration and is closely related to the thermal…
Introduction of polarizability in classical molecular simulations holds the promise to increase accuracy as well as prediction power to computer modeling. To introduce polarizability in a straight-forward way one strategy is based on Drude…
Methods which aim at universal applicability must be able to describe both weak and strong electronic correlation with equal facility. Such methods are in short supply. The combination of symmetry projection for strong correlation and…
The GW approach produces highly accurate quasiparticle energies, but its application to large systems is computationally challenging, which can be largely attributed to the difficulty in computing the inverse dielectric matrix. To address…
Basis set incompleteness error and finite size error can manifest concurrently in systems for which the two effects are phenomenologically well-separated in length scale. When this is true, we need not necessarily remove the two sources of…
The method of the effective action for the composite operators $\Phi^2(x)$ and $\Phi^4(x)$ is applied to the termodynamics of the scalar quantum field with $\lambda\Phi^4$ interaction. An expansion of the finite temperature effective…
We consider the supersymmetric Wess-Zumino model at large $N$ in $(2+1)$ dimension. We introduce a chemical potential($\mu$) at finite temperature($T$). The non-trivial fixed point of this model is described by a pair of coupled gap…
The emergence of fine-grained numerical formats like NVFP4 presents new opportunities for efficient Large Language Model (LLM) inference. However, it is difficult to adapt existing Post-Training Quantization (PTQ) strategies to these…
In [7], a cluster expansion method has been developed to study the fluctuations of the hard sphere dynamics around the Boltzmann equation. This method provides a precise control on the exponential moments of the empirical measure, from…
A method is proposed to approximate the unlimited subcritical set of Mayer`s reducible cluster integrals (i.e., the power coefficients of the known virial expansions for pressure and density in powers of activity) on the basis of…
This paper deals with nonparametric estimation of conditional den-sities in mixture models in the case when additional covariates are available. The proposed approach consists of performing a prelim-inary clustering algorithm on the…
Scalar field theory at finite temperature is investigated via an improved renormalization group prescription which provides an effective resummation over all possible non-overlapping higher loop graphs. Explicit analyses for the lambda…
The large and chemically diverse GMTKN55 benchmark was used as a training set for parametrizing composite wave function thermochemistry protocols akin to G4(MP2)XK theory (Chan et al, JCTC 2019, 15, 4478-4484). Even after reparametrization,…
The Taylor expansion of thermodynamic observables at a finite baryon chemical potential $\mu_B$ is an oft-used method to circumvent the well-known sign problem of Lattice QCD. Owing to the associated difficulty and limitations of precision…
Large language models have transformed the comprehension and generation of natural language tasks, but they come with substantial memory and computational requirements. Quantization techniques have emerged as a promising avenue for…