Related papers: Large-scale Atomistic Simulation of Quantum Effect…
The powerful molecular dynamics (MD) simulation is basically based on a picture that the atoms experience classical-like trajectories under the exertion of classical force field determined by the quantum mechanically solved electronic…
We propose a method of simulating efficiently many-body interacting fermion lattice models in trapped ions, including highly nonlinear interactions in arbitrary spatial dimensions and for arbitrarily distant couplings. We map products of…
We present a computationally efficient general first-principles based method for spin-lattice simulations for solids. Our method is based on a combination of atomistic spin dynamics and molecular dynamics, expressed through a spin-lattice…
Quantum simulations of High Energy Physics, and especially of gauge theories, is an emerging and exciting direction in quantum simulations. However, simulations of such theories, compared to simulations of condensed matter physics, must…
While universal quantum computers remain under development, analog quantum simulators offer a powerful alternative for understanding complex systems in condensed matter, chemistry, and high-energy physics. One compelling application is the…
Machine learning force fields have emerged as promising tools for molecular dynamics (MD) simulations, potentially offering quantum-mechanical accuracy with the efficiency of classical MD. Inspired by foundational large language models,…
We introduce a scheme for molecular simulations, the Deep Potential Molecular Dynamics (DeePMD) method, based on a many-body potential and interatomic forces generated by a carefully crafted deep neural network trained with ab initio data.…
Gauge theories describe the fundamental forces of nature. However, high-energy dynamics, such as the formation of quark-gluon plasmas, is notoriously difficult to model with classical methods. Quantum simulation offers a promising…
The physical processes at the interface of a low-temperature plasma and a solid are extremely complex. They involve a huge number of elementary processes in the plasma, in the solid as well as charge, momentum and energy transfer across the…
A semiclassical approach that incorporates quantum mechanical behavior of heat capacity in direct caloric effect simulations is proposed. Application of this methodology to study electrocaloric effect in prototypical ferroelectrics ${ \rm…
We discuss the effects of quantum fluctuations on the properties of vortex lattices in rapidly rotating ultracold atomic gases. We develop a variational method that goes beyond the Bogoliubov theory by including the effects of interactions…
Many-mode interacting Bose gases (1D,2D,3D) are simulated from first principles. The model uses a second-quantized Hamiltonian with two-particle interactions (possibly ranged), external potential, and interactions with an environment, with…
A framework for quantum simulations of real-time weak decays of hadrons and nuclei in a 2-flavor lattice theory in one spatial dimension is presented. A single generation of the Standard Model is found to require 16 qubits per spatial…
Classical simulation of real-space quantum dynamics is challenging due to the exponential scaling of computational cost with system dimensions. Quantum computer offers the potential to simulate quantum dynamics with polynomial complexity;…
Dimensionality is a fundamental concept in physics, which plays a hidden but crucial role in various domains, including condensed matter physics, relativity and string theory, statistical physics, etc. In quantum physics, reducing…
The rapid advancements in ultrafast laser technology have paved the way for pumping and probing the out-of-equilibrium dynamics of nuclei in crystals. However, interpreting these experiments is extremely challenging due to the complex…
Stimulated by the renewed interest and recent developments in semi-empirical quantum chemical (SQC) methods for noncovalent interactions, we examine the properties of liquid water at ambient conditions by means of molecular dynamics (MD)…
Recent years have enjoyed an overwhelming interest in quantum thermodynamics, a field of research aimed at understanding thermodynamic tasks performed in the quantum regime. Further progress, however, seems to be obstructed by the lack of…
As the temperature of a many-body system approaches absolute zero, thermal fluctuations of observables cease and quantum fluctuations dominate. Competition between different energies, such as kinetic energy, interactions or thermodynamic…
The driven-dissipative many-body problem remains one of the most challenging unsolved problems in quantum mechanics. The advent of quantum computers may provide a unique platform for efficiently simulating such driven-dissipative systems.…