Related papers: Fully Analytic Nuclear Gradients for the Bethe--Sa…
Quantization has become a predominant approach for model compression, enabling deployment of large models trained on GPUs onto smaller form-factor devices for inference. Quantization-aware training (QAT) optimizes model parameters with…
The Bethe-Salpeter (BS) equation for scalar-scalar bound states in scalar theories without derivative coupling is formulated and solved in Minkowski space. This is achieved using the perturbation theory integral representation (PTIR), which…
Deep learning based methods have been widely applied to predict various kinds of molecular properties in the pharmaceutical industry with increasingly more success. Solvation free energy is an important index in the field of organic…
BerkeleyGW is a massively parallel computational package for electron excited-state properties that is based on the many-body perturbation theory employing the ab initio GW and GW plus Bethe-Salpeter equation methodology. It can be used in…
In this paper we propose a simple method for building exactly solvable multi-parameter spectral equations which in turn can be used for constructing completely integrable and exactly solvable quantum systems. The method is based on the use…
Some results obtained by a new method for solving the Bethe-Salpeter equation are presented. The method is valid for any kernel given by irreducible Feynman graphs. The Bethe-Salpeter amplitude, both in Minkowski and in Euclidean spaces,…
A new step-by-step diagonalization procedure for evaluating exact solutions of the nuclear deformed mean-field plus pairing interaction model is proposed via a simple Bethe ansatz in each step from which the eigenvalues and corresponding…
By either performing a Taylor expansion or making a polynomial approximation, the Bethe equation for charged particle stopping power in matter can be integrated analytically to obtain the range of charged particles in the continuous…
We present a highly efficient method for the extraction of optical properties of very large molecules via the Bethe-Salpeter equation. The crutch of this approach is the calculation of the action of the effective Coulombic interaction, $W$,…
This paper resolves a common complexity issue in the Bethe approximation of statistical physics and the Belief Propagation (BP) algorithm of artificial intelligence. The Bethe approximation and the BP algorithm are heuristic methods for…
In neural networks with binary activations and or binary weights the training by gradient descent is complicated as the model has piecewise constant response. We consider stochastic binary networks, obtained by adding noises in front of…
We formulate the Quantum Inverse Scattering Method for the case of anyonic grading. This provides a general framework for constructing integrable models describing interacting hard-core anyons. Through this method we reconstruct the known…
We present a new nonempirical density functional generalized gradient approximation (GGA) that gives significant improvements for lattice constants, crystal structures, and metal surface energies over the most popular Perdew-Burke-Ernzerhof…
In this paper, we aim to solve Bayesian Risk Optimization (BRO), which is a recently proposed framework that formulates simulation optimization under input uncertainty. In order to efficiently solve the BRO problem, we derive nested…
Hedin's $GW$ approximation to the electronic self-energy has been impressively successful to calculate quasiparticle energies, such as ionization potentials, electron affinities, or electronic band structures. The success of this fairly…
We study the exact solution for a two-mode model describing coherent coupling between atomic and molecular Bose-Einstein condensates (BEC), in the context of the Bethe ansatz. By combining an asymptotic and numerical analysis, we identify…
We report an all-electron, atomic orbital (AO) based, two-component (2C) implementation of the $GW$ approximation (GWA) for closed-shell molecules. Our algorithm is based on the space-time formulation of the GWA and uses analytical…
Theoretical expressions for ionization cross sections by electron impact based on the binary encounter Bethe (BEB) model, valid from ionization threshold up to relativistic energies, are proposed. The new modified BEB (MBEB) and its…
We study the photodissociation chemistry of a quantum degenerate gas of bosonic triatomic $ABC$ molecules, assuming two open rearrangement channels ($AB+C$ or $A+BC$). The equations of motion are equivalent to those of a parametric…
The quantitative investigation of the scalar Bethe-Salpeter equation in Minkowski space, within the ladder-approximation framework, is extended to include the excited states. This study has been carried out for an interacting system…