Search Results - "Moro, Giorgio J."
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Quantum computing for classical problems: variational quantum eigensolver for activated processes
Published in New journal of physics (01-12-2021)“…Abstract The theory of stochastic processes impacts both physical and social sciences. At the molecular scale, stochastic dynamics is ubiquitous because of…”
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Quantum Molecular Trajectory and Its Statistical Properties
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (20-07-2017)“…Despite the quantum nature of molecules, classical mechanics is often employed to describe molecular motions that play a fundamental role in a wide range of…”
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Quantum Stochastic Trajectories: The Fokker–Planck–Bohm Equation Driven by the Reduced Density Matrix
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (15-03-2018)“…The quantum molecular trajectory is the deterministic trajectory, arising from the Bohm theory, that describes the instantaneous positions of the nuclei of…”
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Quantum Statistical Ensemble Resilient to Thermalization
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (14-07-2016)“…The sampling of the wave function within a suitable ensemble is an important tool in the statistical analysis of a molecule interacting with its environment…”
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Thermal Pure States for Finite and Isolated Quantum Systems
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (28-09-2017)“…We study an ensemble of quantum pure states, the thermalization resilient ensemble (TRE), providing the statistical characterization of the thermal equilibrium…”
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Typicality in Ensembles of Quantum States: Monte Carlo Sampling versus Analytical Approximations
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (31-12-2009)“…Random quantum states are presently of interest in the fields of quantum information theory and quantum chaos. Moreover, a detailed study of their properties…”
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Typical response of quantum pure states
Published in The European physical journal. B, Condensed matter physics (01-05-2013)“…The response of a quantum system in a pure state to an external force is investigated by reconsidering the standard statistical approach to quantum dynamics in…”
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Director Fluctuations and ESR Spectra: A Slow-Motional Treatment
Published in The journal of physical chemistry. B (08-07-2004)“…The analysis of the influence of director fluctuations on the ESR spectra of a spin probe dissolved in oriented phases (liquid crystals, membranes) requires a…”
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Effects of Electrostatic Interactions on Orientational Order of Solutes in Liquid Crystals
Published in The journal of physical chemistry. B (17-08-2000)“…A mean-field model for the analysis of electrostatic interactions in liquid crystal phases is proposed. The model is based on a realistic description of the…”
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Angular dependence of 2H-NMR longitudinal spin relaxation in aligned nematic 4-n-pentyl-4'-cyanobiphenyl: molecular rotation and director fluctuations
Published in Liquid crystals (05-07-2010)“…The longitudinal (spin-lattice) relaxation in nuclear magnetic resonance (NMR) experiments on 4-n-pentyl-4'-cyanobiphenyl (5CB) mesogen, deuteriated in the…”
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Transverse Nuclear Spin Relaxation in Nematic Liquid Crystals. Angular Dependence of the Relaxation Rate in Pulsed Experiments
Published in Molecular Crystals and Liquid Crystals (03-03-2009)“…The theory underlying the slow-motional description of transverse relaxation in 2 H-NMR pulsed experiments, sensitive to order director fluctuations in nematic…”
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Collective Fluctuations in Ordered Fluids Investigated by Two-Dimensional Electron−Electron Double Resonance Spectroscopy
Published in The journal of physical chemistry. B (30-11-2006)“…Two-dimensional electron−electron double resonance (2D-ELDOR) is a technique that is sensitive to the dynamical processes affecting spin labels in complex…”
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The tunneling splitting and the Kramers theory of activated processes
Published in Chemical physics (01-09-2022)Get full text
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14
Separation of Fast and Slow Processes from a Stochastic Cage Model of Molecular Dynamics
Published in The journal of physical chemistry. B (08-07-2004)“…The linear solute cage model (LSCM) has been proposed in the past [Moro, G. J., Polimeno, A. J. Chem. Phys. 1997, 107, 7884] to account for the action of the…”
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A Stochastic Model for Crankshaft Transitions. II. Analysis of Transition Dynamics
Published in The journal of physical chemistry. B (25-07-2002)“…The three-rotor model introduced in part I (J. Phys. Chem. 1996, 100, 16419) displays transitions of crankshaft type between stable states that are not…”
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Transverse Nuclear Spin Relaxation Studies of Viscoelastic Properties of Membrane Vesicles. II. Experimental Results
Published in The journal of physical chemistry. B (30-05-2002)“…Transverse nuclear spin relaxation measurements employing Carr−Purcell (CP) pulse sequences have been used to determine the viscoelastic properties of…”
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Signatures of Anderson localization and delocalized random quantum states
Published in Chemical physics (25-10-2018)“…We consider the notion of equilibration for an isolated quantum system exhibiting Anderson localization. The system is assumed to be in a pure state, i.e.,…”
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Transverse Nuclear Spin Relaxation Studies of Viscoelastic Properties of Membrane Vesicles. I. Theory
Published in The journal of physical chemistry. B (30-05-2002)“…Transverse nuclear spin relaxation measurements employing Carr−Purcell (CP) pulse sequences can provide detailed information on the slow-motional dynamics in…”
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Magnetic-Field-Induced Orientation of Photosynthetic Reaction Centers, As Revealed by Time-Resolved D-Band Electron Paramagnetic Resonance of Spin-Correlated Radical Pairs. II. Field Dependence of the Alignment
Published in The journal of physical chemistry. B (08-07-2004)“…The magnetic-field-induced orientation of photosynthetic reaction centers has been studied by time-resolved D-band (130 GHz) electron paramagnetic resonance…”
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Saddle point avoidance due to inhomogeneous friction
Published in Chemical physics (01-09-1998)“…The saddle point avoidance due to a position dependent friction is examined in a bidimensional model which can be solved numerically. Both the analysis of the…”
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