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arXiv:2502.14207 · Quantum

Quantum stick-slip motion in nanoscaled friction

Dai-Nam Le, Pablo Rodriguez-López, Lilia M. Woods

Published Apr 16, 2026• 0 citations
arXivHTMLPDF

Abstract

Friction in atomistic systems is usually described by the classical Prandtl-Tomlinson model suitable for capturing the dragging force of a nanoparticle in a periodic potential. Here we consider the quantum mechanical version of this model in which the dissipation is facilitated by releasing heat to an external bath reservoir. The time evolution of the system is captured with the Liouville-von Neumann equation through the density matrix of the system in the Markov approximation. We examine several kinetic and dissipative properties of the nanoparticle by delineating classical vs quantum mechanical effects. We find that the Landau-Zener tunneling is a key factor in the overall reduction of the frictional dissipation when compared to the classical motion in which such tunneling is absent. Other regimes of motion, controlled by the corrugation parameter and other properties, are also found. This in-depth study analyzes the interplay between velocity, strength of interaction, and temperature to control the frictional force and provide useful guidelines for experimental data interpretation.

DOI
10.22331/q-2026-04-16-2070

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Friction in atomistic systems is usually described by the classical Prandtl-Tomlinson model suitable for capturing the dragging force of a nanoparticle in a periodic potential. Here we consider the quantum mechanical version of this model in which the dissipation is facilitated by releasing heat to an external bath reservoir. The time evolution of the system is captured with the Liouville-von Neumann equation through the density matrix of the system in the Markov approximation. We examine several kinetic and dissipative properties of the nanoparticle by delineating classical vs quantum mechanical effects. We find that the Landau-Zener tunneling is a key factor in the overall reduction of the frictional dissipation when compared to the classical motion in which such tunneling is absent. Other regimes of motion, controlled by the corrugation parameter and other properties, are also found. This in-depth study analyzes the interplay between velocity, strength of interaction, and temperature to control the frictional force and provide useful guidelines for experimental data interpretation.
Nanoscaled friction is a fundamental tribological phenomenon with complex behavior of its dynamical force. Here, we utilize the Prandtl-Tomlinson framework to investigate systematically the different means of control of the frictional force at the quantum and classical levels. It is found that the frictional dynamics can be controlled by the corrugation and characteristic length ratio parameters dependent upon properties of the nanoparticle-chain system. In addition to the stick-slip regime, other types of motion are uncovered, highlighting the richness of the frictional dynamics. The importance of Landau-Zener tunneling for the quantum motion is also analyzed. These findings provide valuable insights for interpreting experimental observations and controlling quantum frictional behavior in nanoscale systems.
The quantum motion of nuclei, generally ignored in the physics of sliding friction, can affect in an important manner the frictional dissipation of a light particle forced to slide in an optical lattice. The density matrix-calculated evolution of the quantum version of the basic Prandtl-Tomlinson model, describing the dragging by an external force of a point particle in a periodic potential, shows that purely classical friction predictions can be very wrong. The strongest quantum effect occurs not for weak but for strong periodic potentials, where barriers are high but energy levels in each well are discrete, and resonant Rabi or Landau-Zener tunneling to states in the nearest well can preempt classical stick-slip with nonnegligible efficiency, depending on the forcing speed. The resulting permeation of otherwise unsurmountable barriers is predicted to cause quantum lubricity, a phenomenon which we expect should be observable in the recently implemented sliding cold ion experiments.
The quantum motion of nuclei, generally ignored in sliding friction, can become important for an atom, ion, or light molecule sliding in an optical lattice. The density-matrix-calculated evolution of a quantum Prandtl-Tomlinson model, describing the frictional dragging by an external force of a quantum particle, shows that classical predictions can be very wrong. The strongest quantum effect occurs not for weak, but for strong periodic potentials, where barriers are high but energy levels in each well are discrete, and resonant tunnelling to excited states in the nearest well can preempt classical stick-slip with great efficiency. The resulting permeation of otherwise impassable barriers is predicted to cause quantum lubricity
Previous years researchers began to simulate open quantum system, taking into account the interaction between system and the environment. One approach to deal with this problem is to use the density matrix within the Liouville-von-Neumann formalism or the Markovian variant the Lindblad equations. Another way is to use a stochastic approach where a random force is added to the system. The benefit of the stochastic approach is to solve the dynamics of the system with less time and memory than the density matrix approaches. In this project we want to develop a stochastic approach that can deal with the stochastic wave functions approach. We did this on a 2-level system and found that it works well when comparing to a density matrix approach. Next, we tested a quantum particle connect to a bath of harmonic oscillators using the stochastic approach. We found that a friction term is necessary and applied it. Like in the classical Langevin equations the friction constant and the random force fluctuations are related by the fluctuation-dissipation constant. We showed that with friction the dynamics decays to an ensemble with energy of Egs+kBTE_{gs}+k_BTEgs​+kB​T. However, we also found here are problems. The system seems to absorb energy indefinitely if the temperature is higher than the zero point energy or if the system is a Morse oscillator. Thus more research is required to make this method work.
The dynamics of a mixed quantum-classical system, in which the classical subsystem interacts with a dissipative bath, is investigated. This description of the dynamics will be appropriate if the details of the bath dynamics are unimportant but its presence plays an important role in the dissipation of energy to the environment. In this dynamical description, which can be simulated employing an ensemble of stochastic surface-hopping trajectories, the strength of the dissipation is controlled by a friction coefficient. We show that if decoherence, whose effects are controlled by the bath friction, is sufficiently rapid, the equation of motion can be reduced to a master equation. Thus, decoherence and the validity of master equation models may be explored as a function of bath friction. We use this framework to study the mechanism of decoherence in a simple model nonadiabatic chemical reaction.
We report on a microscopic theory of quantum friction. Our approach investigates the interplay between the dispersive response and the relative center-of-mass motion of two ground-state atoms. This coupling yields a quantum force, which can be expressed as a power series in the velocity. The significance of each contribution depends on its order parity: while even-order terms are reversible, odd-order terms are irreversible and only survive in the presence of an internal dissipation mechanism. In addition, we obtain general, model-independent properties for the work performed by these contributions for arbitrary scattering trajectories. These results enable an unambiguous identification of odd-parity terms with microscopic quantum friction. At room temperature, the dominant microscopic quantum friction is of first order in the velocity and presents a strong quantum character. Our microscopic theory reveals that several properties of quantum friction obtained in specific settings -- such as the cubic dependence on velocity at zero temperature -- are indeed universal features already present at the atomic scale.