Concept

Expectation value (quantum mechanics)

Related publications (10)

Empirical Sample Complexity of Neural Network Mixed State Reconstruction

Giuseppe Carleo, Filippo Vicentini, Haimeng Zhao

Quantum state reconstruction using Neural Quantum States has been proposed as a viable tool to reduce quantum shot complexity in practical applications, and its advantage over competing techniques has been shown in numerical experiments focusing mainly on ...

Verein Forderung Open Access Publizierens Quantenwissenschaf2024

Toward data-driven materials design: From atoms to pilot plants

Kevin Maik Jablonka

Discovering new materials is essential but challenging, time-consuming, and expensive.In many cases, simulations can be useful for estimating material properties. For many of the most interesting properties, however, simulations are infeasible because of p ...

EPFL2023

Nonperturbative Quantum Field Theory in Curved Spacetime

Kamran Salehi Vaziri

Quantum Field Theory(QFT) as one of the most promising frameworks to study high energy and condensed matter physics, has been mostly developed by perturbative methods. However, perturbative methods can only capture a small island of the space of QFTs.QFT i ...

EPFL2022

Accurate Description of Nuclear Quantum Effects with High-Order Perturbed Path Integrals (HOPPI)

Michele Ceriotti, Venkat Kapil

Imaginary time path-integral (PI) simulations that account for nuclear quantum effects (NQE) beyond the harmonic approximation are increasingly employed together with modern electronic-structure calculations. Existing PI methods are applicable to molecules ...

AMER CHEMICAL SOC2020

Initial or final values for semiclassical evolutions in the Weyl–Wigner representation

David Eduardo Zambrano Ramirez

Initial value representations are constructed to avoid the search for trajectories that are only defined in semiclassical approximations by their boundary conditions. We show how to incorporate these procedures within the full Weyl representation, so that ...

2013

Communication: Angular momentum alignment and fluorescence polarization of alkali atoms photodetached from helium nanodroplets

The theory of photofragments angular momentum polarization is applied to the photodetachment of an electronically excited alkali atom from a helium nanocluster (N = 200). The alignment of the electronic angular momentum of the bare excited alkali atoms pro ...

Amer Inst Physics2013

The validation project on the TORPEX basic plasma physics experiment

Ambrogio Fasoli, Ivo Furno, Paolo Ricci, Christian Gabriel Theiler, Joaquim Loizu Cisquella, Fabio Avino, Sébastien Jolliet, Federico David Halpern, Annamaria Mosetto

Owing to its detailed diagnostics, feasibility of parameter scans, and relatively simple configuration, the basic plasma physics experiment TORPEX is an ideal testbed in which to perform experiment/simulation comparisons and to contribute to the establishm ...

2013

Coupling quantum and continuum scales to predict crack tip dislocation nucleation

William Curtin, Derek Warner

A quantum-continuum multiscale coupling of Kohn-Sham density functional theory to continuum material is presented that can handle mechanics problems in metals when long-range stress fields are present, such as occurs for dislocations and cracks. The method ...

2010

Irreversible evolution of many-electron systems: From the quantum-Boltzmann equation toward the semi-classical Boltzmann equation

Starting from the quantum-Boltzmann equation derived in a previous paper, we study the irreversible evolution of an electron gas in the one-particle phase space. The connection with phase space is established by expressing one-electron states in terms of t ...

2008

Sign of the state-to-state steric asymmetry of rotationally inelastic atom-molecule collisions

Marcel Drabbels

The sign of the theoretically predicted steric asymmetry S in rotational inelastic state resolved molecule–atom collisions is questioned. It is shown that the sign of the T-matrix obtained on a basis of non-oriented rotational states of the molecule depend ...

2004

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