Spin-bath polarization via disentanglement

Spin bath polarization is the key to enhancing the sensitivity of quantum sensing and information processing. Significant effort has been invested in identifying the consequences of quantumness and its control for spin-bath polarization. Here, by contrast, we focus on the adverse role of quantum correlations (entanglement) in a spin bath that can impede its cooling in many realistic scenarios. We propose to remove this impediment by modified cooling schemes, incorporating probe-induced disentanglement via alternating, non-commuting probe-bath interactions, so as to suppress the buildup of quantum correlations in the bath. The resulting bath polarization is thereby exponentially enhanced. The underlying thermodynamic principles have far-reaching implications for quantum technological applications

Reproducing Quantum Probability Distributions at the Speed of Classical Dynamics: A New Approach for Developing Force-Field Functors

Modeling nuclear quantum effects is required for accurate molecular dynamics (MD) simulations of molecules. The community has paid special attention to water and other biomolecules that show hydrogen bonding. Standard methods of modeling nuclear quantum effects like Ring Polymer Molecular Dynamics (RPMD) are computationally costlier than running classical trajectories. A force-field functor (FFF) is an alternative method that computes an effective force field which replicates quantum properties of the original force field. In this work, we propose an efficient method of computing FFF using the Wigner-Kirkwood expansion. As a test case, we calculate a range of thermodynamic properties of Neon, obtaining the same level of accuracy as RPMD, but with the shorter runtime of classical simulations. By modifying existing MD programs, the proposed method could be used in the future to increase the efficiency and accuracy of MD simulations involving water and proteins.

Single-atom heat machines enabled by energy quantization

Quantization of energy is a quintessential characteristic of quantum systems. Here we analyze its effects on the operation of Otto cycle heat machines and show that energy quantization alone may alter and increase machine performance in terms of output power, efficiency, and even operation mode. Our results demonstrate that quantum thermodynamics enable the realization of classically inconceivable Otto machines, such as those with an incompressible working fluid. We propose to measure these effects experimentally using a laser-cooled trapped ion as a microscopic heat machine.

Optical Spectra of p-Doped PEDOT Nano-Aggregates Provide Insight into the Material Disorder

Highly doped Poly(3,4-ethylenedioxythiophene) or PEDOT is a conductive polymer with a wide range of applications in energy conversion due to its ease of processing, optical properties and high conductivity. The latter is influenced by processing conditions, including formulation, annealing, and solvent treatment of the polymer, which also affects the polymer arrangement. Here we show that the analysis of the optical spectra of PEDOT domains reveals the nature and magnitude of the structural disorder in the material. In particular, the optical spectra of objects on individual domains can be used for the elucidation of the molecular disorder in oligomer arrangement which is a key factor affecting the conductivity.