相关论文: CrysFieldExplorer: a software for rapid optimizati…
We discuss the calculation of crystal field splittings using Wannier functions and show how the ligand field contributions can be separated from the bare Coulomb contribution to the crystal field by constructing sets of Wannier functions…
The cross-entropy (CE) method is simple and versatile technique for optimization, based on Kullback-Leibler (or cross-entropy) minimization. The method can be applied to a wide range of optimization tasks, including continuous, discrete,…
Application of artificial intelligence (AI) has been ubiquitous in the growth of research in the areas of basic sciences. Frequent use of machine learning (ML) and deep learning (DL) based methodologies by researchers has resulted in…
When maximum likelihood estimation is infeasible, one often turns to score matching, contrastive divergence, or minimum probability flow to obtain tractable parameter estimates. We provide a unifying perspective of these techniques as…
Fastlim is a tool to calculate conservative limits on extensions of the Standard Model from direct LHC searches without performing any Monte Carlo event generation. The program reconstructs the visible cross sections from pre-calculated…
A new scheme for the short baseline electron antineutrino (${\bar{\nu}}_{e}$) disappearance study is investigated. We propose to use an intense neutron emitter, $^{252}$Cf, which produces $^{8}$Li isotope through the…
Cyclotomic fast Fourier transforms (CFFTs) are efficient implementations of discrete Fourier transforms over finite fields, which have widespread applications in cryptography and error control codes. They are of great interest because of…
We propose a novel adaptive damping algorithm for the self-consistent field (SCF) iterations of Kohn-Sham density-functional theory, using a backtracking line search to automatically adjust the damping in each SCF step. This line search is…
Crystal dislocation dynamics, especially at high temperatures, represents a subject where experimental phenomenological input is commonly required, and parameter-free predictions, starting from quantum methods, have been beyond reach. This…
Particle picking is currently a critical step in the cryo-EM single particle reconstruction pipeline. Despite extensive work on this problem, for many data sets it is still challenging, especially for low SNR micrographs. We present the KLT…
A numerical tool for analysing spatially anisotropic electron populations in electron cyclotron resonance (ECR) plasmas has been developed, using a trial-and-error electron energy distribution function (EEDF) fitting method. The method has…
CryoCsI, the proposed prototype, is a cryogenic undoped CsI scintillating detector, which has a much lower energy threshold potentially down to 0.5 keV$_{nr}$ compared to the doped CsI. This enhanced sensitivity of CryoCsI allows for the…
With the success of transformer architectures across diverse applications, the error correction code transformer (ECCT) has gained significant attention for its superior decoding performance. In spite of its advantages, the error floor…
Structural dynamics of macromolecules is critical to their structural-function relationship. Cryogenic electron microscopy (CryoEM) provides snapshots of vitrified protein at different compositional and conformational states, and the…
When a pulsed, few-cycle electromagnetic wave is focused by optics with f-number smaller than two, the frequency components it contains are focused to different regions of space, building up a complex electromagnetic field structure.…
Quasi-isentropic compression is an effective method to achieve high-density and high-temperature implosion in laser-driven inertial confinement fusion (ICF). However, it requires precise matching between the laser profile and the target…
We present an algorithm for sparse Hamiltonian simulation whose complexity is optimal (up to log factors) as a function of all parameters of interest. Previous algorithms had optimal or near-optimal scaling in some parameters at the cost of…
A cryogenic detector system based on two 3.3 kg high-purity CsI crystals was developed and characterized at approximately 95 K. Each wedge-shaped crystal was coupled to dual-ended 3-inch photomultiplier tubes (PMTs) for scintillation…
Crystal scintillators provide potential merits for the pursuit of low-energy low-background experiments. A CsI(Tl) scintillating crystal detector is being constructed to study low-energy neutrino physics at a nuclear reactor, while projects…
Multi-objective embedding-based retrieval (EBR) has become increasingly critical due to the growing complexity of user behaviors and commercial objectives. While traditional approaches often suffer from data sparsity and limited information…