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To understand the properties and interactions of materials, and determining the ground state energies is one of the important challenges in quantum chemistry, materials science, and quantum mechanics, where quantum computing can play an…

量子物理 · 物理学 2025-04-15 Badie Ghavami , Forouzan Mirmasoudi

The Hamilton-Jacobi method of constrained systems is discussed. The equations of motion of a singular system with time dependent constraints are obtained as total differential equations in many variables. The integrability conditions for…

数学物理 · 物理学 2009-11-07 Sami I. Muslih

The path integral formulation of quantum mechanics, i.e., the idea that the evolution of a quantum system is determined as a sum over all the possible trajectories that would take the system from the initial to its final state of its…

量子物理 · 物理学 2024-06-12 Charles W. Robson , Yaraslau Tamashevich , Tapio T. Rantala , Marco Ornigotti

In this paper, a complete covariant quantization of generalized electrodynamics is shown through the path integral approach. To this goal, we first studied the hamiltonian structure of system following Dirac's methodology and, then, we…

高能物理 - 理论 · 物理学 2011-02-18 Rodrigo Bufalo , Bruto Max Pimentel , German Enrique Ramos Zambrano

Path integral Monte Carlo with Green's function analysis allows the sampling of quantum mechanical properties of molecules at finite temperature. While a high-precision computation of the energy of the Born-Oppenheimer surface from path…

量子物理 · 物理学 2007-05-23 Daejin Shin , Ming-Chak Ho , J. Shumway

We report on the calculation of the ground-state atomic kinetic energy, $E_{k}$, and momentum distribution of solid Ne by means of the diffusion Monte Carlo method and Aziz HFD-B pair potential. This approach is shown to perform notably for…

其他凝聚态物理 · 物理学 2009-11-13 C. Cazorla , J. Boronat

Dynamical response functions are fundamental quantities to describe the excited-state properties in quantum many-body systems. Quantum algorithms have been proposed to evaluate these quantities by means of quantum phase estimation (QPE),…

量子物理 · 物理学 2024-08-27 Rei Sakuma , Shu Kanno , Kenji Sugisaki , Takashi Abe , Naoki Yamamoto

The Feynman path integral in p-adic quantum mechanics is considered. The probability amplitude ${\cal K}_p (x^{\prime\prime},t^{\prime\prime}; x^\prime,t^\prime)$ for one-dimensional systems with quadratic actions is calculated in an exact…

数学物理 · 物理学 2009-10-31 G. S. Djordjevic , B. Dragovich

Variational Monte Carlo method is used to calculate ground state properties of $^4$He droplets, containing 70, 112, 168, 240, 330, and 728 particles. The resulting particle and kinetic energy densities are used as an input in the…

凝聚态物理 · 物理学 2009-10-22 A. Belić , F. Dalfovo , S. Fantoni , S. Stringari

The precise description of quantum nuclear fluctuations in atomistic modelling is possible by employing path integral techniques, which involve a considerable computational overhead due to the need of simulating multiple replicas of the…

化学物理 · 物理学 2017-03-23 Venkat Kapil , Jörg Behler , Michele Ceriotti

An effective field theory technique that combines the standard nuclear physics approach and chiral perturbation theory is applied to the $hen$ process, ${}^{3}{He}+n\to {}^{4}{He}+ \gamma$. For the initial and final nuclear states,…

核理论 · 物理学 2007-05-23 Young-Ho Song , Tae-Sun Park

We present a stochastic path integral formalism for continuous quantum measurement that enables the analysis of rare events using action methods. By doubling the quantum state space to a canonical phase space, we can write the joint…

量子物理 · 物理学 2013-10-16 A. Chantasri , J. Dressel , A. N. Jordan

We study the application of the coherent-state path integral as a numerical tool for wave-packet propagation. The numerical evaluation of path integrals is reduced to a matrix-vector multiplication scheme. Together with a split-operator…

量子物理 · 物理学 2007-05-23 Bernd Burghardt , Joachim Stolze

In current studies of mean-field quantum spin systems, much attention is placed on the calculation of the ground-state energy and the excitation gap, especially the latter which plays an important role in quantum annealing. In pure systems,…

无序系统与神经网络 · 物理学 2018-03-26 Yang Wei Koh

The article is devoted to numerical studies of atomic (metal) hydrogen with Path Integral Monte Carlo (PIMC) technique. The research is focused on the range of temperatures and densities where quantum statistics effects are crucial for…

其他凝聚态物理 · 物理学 2013-04-10 Alexander Novoselov , Oleg Pavlovsky , Maxim Ulybyshev

Using a Hubbard-Stratonovich transformation coupled with Fourier path integral methods, expressions are derived for the numerical evaluation of the microcanonical density of states for quantum particles obeying Boltzmann statistics. A…

chem-ph · 物理学 2009-10-22 David L. Freeman , J. D. Doll

We study the ground and excited states of weakly interacting Bose gases (with positive and negative scattering lengths) in connection with Bose Einstein Condensation to test the validity of the mean field theory and Born approximation. They…

统计力学 · 物理学 2007-05-23 S . Datta

Crank-Nicolson (C-N) Method combined with $ B $-spline basis set can be used in both time-dependent and time-independent calculations of the photoionization cross sections of atoms and molecules. For time-independent systems, it is found…

原子物理 · 物理学 2014-09-15 Xue-Bin Bian

A path integral Monte Carlo method (PIMC) based on Feynman-Kac formula for mixed boundary conditions of elliptic equations is proposed to solve the forward problem of electrical impedance tomography (EIT) on the boundary to obtain…

数值分析 · 数学 2019-08-01 Yijing Zhou , Wei Cai

A quantum measurement model based upon restricted path-integrals allows us to study measurements of generalized position in various one-dimensional systems of phenomenological interest. After a general overview of the method we discuss the…

量子物理 · 物理学 2008-02-03 Tommaso Calarco , Roberto Onofrio , Carlo Presilla , Lorenza Viola