相关论文: Multiple Spawning with Optimal Basis Set Expansion
Full Multiple Spawning offers an in principle exact framework for excited-state dynamics, where nuclear wavefunctions in different electronic states are represented by a set of coupled trajectory basis functions that follow classical…
Density matrix renormalization group (DMRG) or matrix product states (MPS) is the most effective and accurate method for studying one-dimensional quantum many-body systems. However, the application of DMRG to two-dimensional systems is not…
The aim of this work is to propose a new multiphysics mode synthesis (MMS) for the thermomechanical vibration problem. The present thermomechanical model is based on a state-space formulation, which consists of displacement, velocity, and…
There has long been interest to control the transfer of population between specified quantum states. Recent work has optimized the control law for closed system population transfer by using a gradient ascent pulse engineer- ing algorithm…
While general quantum many-body systems require exponential resources to be simulated on a classical computer, systems of non-interacting fermions can be simulated exactly using polynomially scaling resources. Such systems may be of…
The mapping approach addresses the mismatch between the continuous nuclear phase space and discrete electronic states by creating an extended, fully continuous phase space using a set of harmonic oscillators to encode the populations and…
Computational modeling of assembly is challenging for many systems because their timescales vastly exceed those accessible to simulations. This article describes the MultiMSM, which is a general framework that uses Markov state models…
In the stochastic mean-field (SMF) approach, an ensemble of initial values for a selected set of one-body observables is formed by stochastic sampling from a phase-space distribution that reproduces the initial quantum fluctuations.…
The nucleation and propagation of disconnections play an essential role during twin growth. Atomistic methods can reveal such small structural features on twin facets and model their motion, yet are limited by the simulation length and time…
Multiconfiguration pair-density functional theory (MC-PFDT) has previously been applied successfully to carry out ground-state and excited-state calculations. However, because it includes no interaction between electronic states, MC-PDFT…
This paper investigates an under-explored but important problem: given a collection of pre-trained neural networks, predicting their performance on each multi-modal task without fine-tuning them, such as image recognition, referring,…
The Fast Multipole Method (FMM) offers an acceleration for pairwise interaction calculation, known as $N$-body problems, from $\mathcal{O}(N^2)$ to $\mathcal{O}(N)$ with $N$ particles. This has brought dramatic increase in the capability of…
The modeling of out-of-equilibrium many-body systems requires to go beyond the low-energy physics and local densities of states. Many-body localization, presence or lack of thermalization and quantum chaos are examples of phenomena in which…
In this paper, we have proposed and demonstrated a new method of atomic population transfer. Transition dynamic of a two-level system is studied in a full quantum description of the Jaynes-Cummings model. Solving the time-dependent…
We present an all-optical method for efficiently preparing cold atoms in a desired Zeeman state, either on the magnetically insensitive clock state (m_F=0) or a particular state suitable for processing or storing quantum information. By…
Foundation models have shown great success in natural language processing, computer vision, and multimodal tasks. FMs have a large number of model parameters, thus requiring a substantial amount of data to help optimize the model during the…
We report an ultrafast and efficient way to create the maximum coherence between the two lower states in a -like atomic systems, driven by two nonlinearly chirped few-cycle pulses. The phenomenon of coherent population trapping and…
Out-of-equilibrium dynamics of non-integrable Hamiltonian many-body quantum systems are characterized by highly entangled wave functions. Near-maximal entanglement arises in systems exhibiting thermalization or pre-thermalization, where the…
In the era of noisy, intermediate-scale quantum (NISQ) devices, the efficient preparation of many-body resource states is a task of paramount importance. In this paper we focus on the deterministic preparation of matrix-product states (MPS)…
Multimode Gaussian states are a versatile resource for quantum information technologies and have been realized across a wide range of physical platforms. Recent progress in the large-scale generation of such states provides a key ingredient…