Related papers: Analytical Nuclear Gradients for State-Averaged Co…
Analytical solutions to differential equations offer exact, interpretable insight but are rarely available because discovering them requires expert intuition or exhaustive search of combinatorial spaces. We introduce SIGS, a neuro-symbolic…
We investigate the sensitivity of low-energy nuclear collisions to intrinsic nuclear structure by studying the interplay between initial-state geometry and final-state observables in C+C and C+Pb collisions at $\sqrt{s_{NN}}=2.36$~GeV,…
An iterative configuration interaction (iCI)-based multiconfigurational self-consistent field (SCF) theory, iCISCF, is proposed to handle systems that require large complete active spaces (CAS). The success of iCISCF stems from three…
Co-prime arrays with compressed inter-element spacing (CACIS) is one of the generalizations of the co-prime array. The inter-element spacing can be varied in this case. The prototype co-prime arrays and nested arrays are a special case of…
A recently proposed local self-interaction correction (LSIC) method [Zope \textit{et al.} J. Chem. Phys., 2019,{\bf 151}, 214108] when applied to the simplest local density approximation provides significant improvement over standard…
We investigate the nuclear equation of state (EoS) for isospin-asymmetric matter using a new set of RMF interactions with the $\sigma$-$\delta$ and $\omega$-$\rho$ mixing, referred to as the OMEG family. These interactions are optimized so…
The nuclear-electronic orbital (NEO) approach incorporates nuclear quantum effects into quantum chemistry calculations by treating specified nuclei quantum mechanically, equivalently to the electrons. Within the NEO framework, excited…
After the first observation of coherent elastic neutrino-nucleus scattering (CE$\nu$NS) by the COHERENT collaboration, many efforts are being made to improve the measurement of this process, making it possible to constrain new physics in…
A new state specific correlation correction to configuration interaction singles (CIS) excitation energies is preseted using coupled cluster perturbation theory (CCPT). General expressions for CIS-CCPT are derived and expanded explicitly to…
Using the new results on coherent elastic neutrino-nucleus scattering data in cesium-iodide provided by the COHERENT experiment, we determine a new measurement of the average neutron rms radius of $^{133}\text{Cs}$ and $^{127}\text{I}$. In…
Systematic calculations of ground-state spin and parity of odd-mass nuclei have been performed within the Hartree--Fock--BCS (HFBCS) approach and the Finite-Range Droplet Model for nuclei for which experimental data are available. The…
We propose a complex-valued neural-network (CV-NN) framework to optimally configure stacked intelligent surfaces (SIS) in next-generation multi-antenna systems. Unlike conventional solutions that separately tune analog metasurface phases or…
Optically-active solid-state systems such as self-assembled quantum dots, rare-earth ions, and color centers in diamond and SiC are promising candidates for quantum network, computing, and sensing applications. Although the nuclei in these…
Full configuration interaction (FCI) solvers are limited to small basis sets due to their expensive computational costs. An optimal orbital selection for FCI (OptOrbFCI) is proposed to boost the power of existing FCI solvers to pursue the…
In this paper, we consider solving the distributed optimization problem over a multi-agent network under the communication restricted setting. We study a compressed decentralized stochastic gradient method, termed ``compressed exact…
The concept of machine learning configuration interaction (MLCI) [J. Chem. Theory Comput. 2018, 14, 5739], where an artificial neural network (ANN) learns on the fly to select important configurations, is further developed so that accurate…
The electronic structure of the ICl+ molecular ion is investigated by using high-level multireference configuration interaction (MRCI) method. To improve computational accuracy, Davidson corrections, spin-orbit coupling (SOC), and…
Conical intersections play a pivotal role in excited-state quantum dynamics. Capturing transient molecular structures near conical intersections remains challenging due to the rapid timescales and subtle structural changes involved. We…
Integrated sensing and communication (ISAC), assisted by reconfigurable intelligent surface (RIS) has emerged as a breakthrough technology to improve the capacity and reliability of 6G wireless network. However, a significant challenge in…
Referring Remote Sensing Image Segmentation (RRSIS) is a new challenge that combines computer vision and natural language processing, delineating specific regions in aerial images as described by textual queries. Traditional Referring Image…