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Molecular line emission is a powerful probe of the physical conditions of astrophysical objects but can be complex to model, and it is often unclear which transitions would be the best targets for observers who wish to constrain a given…

Astrophysics of Galaxies · Physics 2022-02-09 Jonathan Holdship , Serena Viti

Data analytics and data science play a significant role in nowadays society. In the context of Smart Grids (SG), the collection of vast amounts of data has seen the emergence of a plethora of data analysis approaches. In this paper, we…

Other Computer Science · Computer Science 2019-12-02 Bruno Rossi , Stanislav Chren

The recent development of energy-resolving scintillation crystals opens the way to new types of applications and imaging systems. In the context of computerized tomography (CT), it enables to use the energy as a dimension of information…

Numerical Analysis · Mathematics 2022-07-13 Lorenz Kuger , Gael Rigaud

The primary goal of Galactic archaeology is to learn about the origin of the Milky Way from the detailed chemistry and kinematics of millions of stars. Wide-field multi-fibre spectrographs are increasingly used to obtain spectral…

Spectroscopy underpins modern scientific discovery across diverse disciplines. While experimental spectroscopy probes material properties through scattering or radiation measurements, computational spectroscopy combines theoretical models…

Molecular spectroscopy in the mid-infrared portion of the electromagnetic spectrum (3--25 um) has been a cornerstone interdisciplinary analytical technique widely adapted across the biological, chemical, and physical sciences. Applications…

Instrumentation and Detectors · Physics 2018-09-18 Abijith S. Kowligy , Henry Timmers , Alex Lind , Ugaitz Elu , Flavio C. Cruz , Peter G. Schunemann , Jens Biegert , Scott A. Diddams

We report multipronged progress on the stochastic averaging approach to numerical analytic continuation of quantum Monte Carlo data. With the sampled spectrum parametrized with delta-functions in continuous frequency space, a calculation of…

Strongly Correlated Electrons · Physics 2023-01-11 Hui Shao , Anders W. Sandvik

In a search scenario, nuclear background spectra are continuously measured in short acquisition intervals with a mobile detector-spectrometer. Detecting sources from measured data is difficult because of low signal to noise ratio (S/N) of…

Data Analysis, Statistics and Probability · Physics 2014-11-18 Marvin Weinstein , Alexander Heifetz , Raymond Klann

In the past few decades, the life sciences have experienced an unprecedented accumulation of data, ranging from genomic sequences and proteomic profiles to heavy-content imaging, clinical assays, and commercial biological products for…

Databases · Computer Science 2025-09-22 Rosalia Moreddu

Computational chemistry plays a relevant role in many astrochemical research fields, either by complementing experimental measurements or by deriving parameters difficult to be reproduced by laboratories. While the role of computational…

Astrophysics of Galaxies · Physics 2024-09-12 Francesca Tonolo , Silvia Alessandrini

Mass spectrometry is the dominant technology in the field of proteomics, enabling high-throughput analysis of the protein content of complex biological samples. Due to the complexity of the instrumentation and resulting data, sophisticated…

Unfolding, in the context of high-energy particle physics, refers to the process of removing detector distortions in experimental data. The resulting unfolded measurements are straightforward to use for direct comparisons between…

We propose a detailed investigation of the schematic mode-coupling approach to experimental data, a method based on the use of simple mode-coupling equations to analyze the dynamics of supercooled liquids. Our aim here is to clarify…

Disordered Systems and Neural Networks · Physics 2009-11-07 V. Krakoviack , C. Alba-Simionesco

In a world made of atoms, the computer simulation of molecular systems, such as proteins in water, plays an enormous role in science. Software packages that perform these computations have been developed for decades. In molecular…

Chemical Physics · Physics 2024-08-07 Philipp Hoellmer , A. C. Maggs , Werner Krauth

Physical theories that depend on many parameters or are tested against data from many different experiments pose unique challenges to statistical inference. Many models in particle physics, astrophysics and cosmology fall into one or both…

Previous and present "academic" research aiming at atomic scale understanding is mainly concerned with the study of individual molecular processes possibly underlying materials science applications. Appealing properties of an individual…

Materials Science · Physics 2015-06-24 Karsten Reuter , Catherine Stampfl , Matthias Scheffler

Two-dimensional electronic spectroscopy has become one of the main experimental tools for analyzing the dynamics of excitonic energy transfer in large molecular complexes. Simplified theoretical models are usually employed to extract model…

Chemical Physics · Physics 2019-01-17 Mirta Rodríguez , Tobias Kramer

Metadata is one of the most important aspects for advancing data management practices within all research communities. Definitions and schemes of metadata are inter alia of particular significance in the domain of neutron and photon…

Data Analysis, Statistics and Probability · Physics 2025-01-29 Amir Tosson , Mohammad Reza , Christian Gutt

We discuss the topical and fundamental problem of strong-coupling between a quantum dot an the single mode of a microcavity. We report seminal quantitative descriptions of experimental data, both in the linear and in the nonlinear regimes,…

Mesoscale and Nanoscale Physics · Physics 2010-07-12 F. P. Laussy , E. del Valle , A. Gonzalez-Tudela , E. Cancellieri , D. Sanvitto , C. Tejedor

The understanding of molecular structure and function is at the very heart of the chemical and molecular sciences. Experiments that allow for the creation of structurally pure samples and the investigation of their molecular dynamics and…

Chemical Physics · Physics 2015-10-20 Yuan-Pin Chang , Daniel A. Horke , Sebastian Trippel , Jochen Küpper
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