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We present ground and excited state energies obtained from Diffusion Monte Carlo (DMC) calculations, using accurate multiconfiguration wave functions, for $N$ electrons ($N\le13$) confined to a circular quantum dot. We analyze the…

Condensed Matter · Physics 2009-10-31 F. Pederiva , C. J. Umrigar , E. Lipparini

Efficient Monte Carlo (MC) sampling of many-body systems with long-range electrostatics is often limited by the cost of per-move energy-difference evaluation under periodic boundary conditions. We present DMK-MC, an accelerated MC method…

Computational Physics · Physics 2026-01-15 Xuanzhao Gao , Shidong Jiang , Jiuyang Liang , Qi Zhou

Density matrix quantum Monte Carlo (DMQMC) is used to sample exact-on-average $N$-body density matrices for uniform electron gas systems of up to 10$^{124}$ matrix elements via a stochastic solution of the Bloch equation. The results of…

Strongly Correlated Electrons · Physics 2016-09-14 Fionn D. Malone , N. S. Blunt , Ethan W. Brown , D. K. K. Lee , J. S. Spencer , W. M. C. Foulkes , James J. Shepherd

We use the diffusion Monte Carlo method to calculate the doubly heavy tetraquark $T_{cc}$ system in two kinds of constituent quark models, the pure constituent quark model AL1/AP1 and the chiral constituent quark model. When the discrete…

High Energy Physics - Phenomenology · Physics 2024-04-03 Yao Ma , Lu Meng , Yan-Ke Chen , Shi-Lin Zhu

We develop a time-dependent variational Monte Carlo (t-VMC) method for quantum dynamics of strongly correlated electrons. The t-VMC method has been recently applied to bosonic systems and quantum spin systems. Here, we propose a…

Strongly Correlated Electrons · Physics 2015-12-22 Kota Ido , Takahiro Ohgoe , Masatoshi Imada

Employing a classical density-functional description of liquid environments, we introduce a rigorous method for the diffusion quantum Monte Carlo calculation of free energies and thermodynamic averages of solvated systems that requires…

In this paper the Diffusion Monte Carlo (DMC) method is applied to the confined hydrogen atom with different confinement geometries. This approach is validated using the much studied spherical and cylindrical confinements and then applied…

Chemical Physics · Physics 2019-03-20 Gaia Micca Longo , Savino Longo , Domenico Giordano

We present a quantum Monte Carlo method capable of sampling the full density matrix of a many-particle system at finite temperature. This allows arbitrary reduced density matrix elements and expectation values of complicated non-local…

Computational Physics · Physics 2015-06-15 N. S. Blunt , T. W. Rogers , J. S. Spencer , W. M. C. Foulkes

The probabilistic interference fringes observed in the double slit experiment vividly demonstrate the quantum superposition principle, yet they also highlight a fundamental conceptual challenge: the relationship between a system before and…

Quantum Physics · Physics 2025-12-29 Ping-Rui Tsai , Tzay-Ming Hong

The Kondo and Periodic Anderson Model (PAM) are known to provide a microscopic picture of many of the fundamental properties of heavy fermion materials and, more generally, a variety of strong correlation phenomena in $4f$ and $5f$ systems.…

Strongly Correlated Electrons · Physics 2019-05-10 N. C. Costa , T. Mendes-Santos , T. Paiva , N. J. Curro , R. R. dos Santos , R. T. Scalettar

In this paper, we apply the full new method of quantum theory to study the double-slit diffraction of ${C_{60}}$ molecules. We calculate the double-slit wave functions of ${C_{60}}$ molecules by Schr\"{o}dinger equation, and calculate the…

Quantum Physics · Physics 2013-05-14 Xiang-Yao Wu , Ji Ma , Bo-Jun Zhang , Hong Li , Xiao-Jing Liu , Nuo Ba , Si-Qi Zhang , Jing Wang , He Dong , Xin-Guo Yin

In the recent years, mater-wave interferometry has attracted growing attention due to its unique suitability for high-precision measurements and study of fundamental aspects of quantum theory. Diffraction and interference of matter waves…

Quantum Physics · Physics 2013-05-30 Arseni Goussev

In low-temperature high-density plasmas quantum effects of the electrons are becoming increasingly important. This requires the development of new theoretical and computational tools. Quantum Monte Carlo methods are among the most…

Statistical Mechanics · Physics 2014-08-12 T. Schoof , S. Groth , M. Bonitz

To make useful connections with experimental measurements, correlated electronic structure theories must accurately predict chemical properties in addition to energies. We present a finite-difference based algorithm to compute first-order…

Chemical Physics · Physics 2025-09-24 Leon Otis , Sri Gudivada , Marvin Friede , James Shee

This article presents a concrete mathematical framework for the generation of entangled quantum states from classical stochastic processes. We demonstrate that any density operator $\rho_{AB}$ of a composite system can be derived from the…

Quantum Physics · Physics 2026-01-27 Andrei Khrennikov

Recent technical advances in dealing with finite-size errors make quantum Monte Carlo methods quite appealing for treating extended systems in electronic structure calculations, especially when commonly-used density functional theory (DFT)…

Materials Science · Physics 2016-10-06 Kyle G. Reeves , Yi Yao , Yosuke Kanai

We develop a real-time Full Configuration Interaction Quantum Monte Carlo approach for the modeling of driven-dissipative open quantum systems. The method enables stochastic sampling of the Liouville-von-Neumann time evolution of the…

Quantum Physics · Physics 2018-06-06 Alexandra Nagy , Vincenzo Savona

The double slit experiment provides a classic example of both interference and the effect of observation in quantum physics. When particles are sent individually through a pair of slits, a wave-like interference pattern develops, but no…

Quantum Physics · Physics 2016-07-01 Joshua Kincaid , Kyle McLelland , Michael Zwolak

A two-slit interference of a massive particle in the presence of environment induced decoherence is theoretically analyzed using a fully quantum mechanical calculation. The Markovian Master equation, derived from coupling the particle to a…

Quantum Physics · Physics 2011-12-09 Tabish Qureshi , Anu Venugopalan

This paper describes the dynamics of a quantum two-level system (qubit) under the influence of an environment modeled by an ensemble of random matrices. In distinction to earlier work, we consider here separable couplings and focus on a…

Quantum Physics · Physics 2015-06-19 M. Carrera , T. Gorin , T. H. Seligman