Single-particle versus pair condensation of hard-core bosons with correlated hopping

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HP - A code for the calculation of Hubbard parameters using density-functional perturbation theory

Nicola Marzari, Matteo Cococcioni, Iurii Timrov

We introduce HP, an implementation of density-functional perturbation theory, designed to compute Hubbard parameters (on-site U and inter-site V ) in the framework of DFT+U and DFT+U+V. The code does not require the use of computationally expensive superce ...

ELSEVIER2022

Influence of static correlation on the magnon dynamics of an itinerant ferromagnet with competing exchange interactions: First-principles study of MnBi

Henrik Moodysson Rønnow, Thorbjørn Skovhus

We present first-principles calculations of the dynamic susceptibility in strained and doped ferromagnetic MnBi using time-dependent density functional theory. In spite of being a metal, MnBi exhibits signatures of strong correlation and a proper descripti ...

AMER PHYSICAL SOC2022

Phase and microstructure selection in peritectic alloys under high G-V ratio

Stéphane Dobler, Wilfried Kurz

A new model for the case of a superposition of a phase transformation and a microstructure transition from columnar plane front to equiaxed dendritic growth for peritectic alloys is presented. This model is applied to Fe-Ni alloys where a phase transition ...

WALTER DE GRUYTER GMBH2022

High-dimensional optimization under nonconvex excluded volume constraints

Antonio Sclocchi

We consider high-dimensional random optimization problems where the dynamical variables are subjected to nonconvex excluded volume constraints. We focus on the case in which the cost function is a simple quadratic cost and the excluded volume constraints a ...

AMER PHYSICAL SOC2022

Microscopic field theory for structure formation in systems of self-propelled particles with generic torques

Ignacio Pagonabarraga Mora, Elena Sesé Sansa

We derive a dynamical field theory for self-propelled particles subjected to generic torques and forces by explicitly coarse-graining their microscopic dynamics, described by a many-body Fokker-Planck equation. The model includes both intrinsic torques ind ...

AIP Publishing2022

Skyrmion Control and Phase Transitions in Cu2OSeO3

Thomas Schönenberger

Magnetic skyrmions are nanometric and non-trivial spin textures with non-zero topological charge. Their robustness against perturbations and the possibility to control them using external stimuli make them ideal candidates for future spintronic application ...

EPFL2022

FEM of stress partition during compression of WC-10 wt.% Co with realistic 3D morphology

Daniele Mari, Lucas Eric Jacques Degeneve

A Finite Element Model is developed to represent the mechanical behavior of WC-10 wt.% Co in compression tests. In this research, realistic three-dimensional model is obtained by slicing a sample by Focused Ion Beam and reconstituting it, resulting in two ...

ELSEVIER SCI LTD2022

Systems and methods for energy-efficient measurement of neurophysiological oscillations

Mahsa Shoaran, Uisub Shin

A system for measuring synchrony between two or more regions, or within a single region, of a subject's brain. The system can include a signal conditioning module in communication with a phase extraction module. The signal conditioning module can receive a ...

2022

Urea Derivative-Promoted CsPbl(2)Br Perovskite Solar Cells with High Open-Circuit Voltage

Xin Guo, Bowen Yang, Yang Liu, Chen Li

Inorganic perovskite solar cells (PSCs) have witnessed extraordinary advances owing to their prominent stability against thermal aging. However, they suffer from a phase transition from black phase to yellow phase under ambient conditions and serious energ ...

WILEY-V C H VERLAG GMBH2022

Time-Synchronization Attack Detection in Unbalanced Three-Phase Systems

Jean-Yves Le Boudec, Mario Paolone, Marguerite Marie Nathalie Delcourt, Gyorgy Miklos Dan

Phasor measurement units (PMU) rely on an accurate time-synchronization to phase-align the phasors and timestamp the voltage and current phasor measurements. Among the symmetrical components computed from the phasors in three-phase systems, the standard pr ...

2021

A quantum magnetic analogue to the critical point of water

Mohamed Zayed, Ludger Weber, Frédéric Mila, Bruce Normand, Henrik Moodysson Rønnow, Julio Antonio Larrea Jiménez, Kazimierz Conder, Ellen Fogh, Christian Rüegg

At the liquid-gas phase transition in water, the density has a discontinuity at atmospheric pressure; however, the line of these first-order transitions defined by increasing the applied pressure terminates at the critical point(1), a concept ubiquitous in ...

2021

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