Global gyrokinetic simulations of TEM microturbulence
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The electronic density of states (DOS) quantifies the distribution of the energy levels that can be occupied by electrons in a quasiparticle picture and is central to modern electronic structure theory. It also underpins the computation and interpretation ...
EPFL2023
The subject of the present work is discovery and in-depth characterization of a new class of functional materials. Tuning of the bond polarity and orbital occupation with a goal of establishing balance between localization and delocalization of electrons - ...
EPFL2023
Free-electron beams are versatile probes of microscopic structure and composition(1,2), and have revolutionized atomic-scale imaging in several fields, from solid-state physics to structural biology(3). Over the past decade, the manipulation and interactio ...
NATURE PUBLISHING GROUP2020
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A transient state of the excess electron in liquid water preceding the development of the solvation shell, the so-called wet electron, has been invoked to explain spectroscopic observations, but its binding energy and atomic structure have remained highly ...
2019
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Gyrokinetic simulations are extensively used as a tool to describe various phenomena in magnetically confined plasmas. Among others, turbulent transport induced by drift-wave type instabilities such as Ion Temperature Gradient (ITG), Trapped Electron Mode ...
2017
In tokamak fusion plasmas, micro-turbulence transport is known to be the cause of large losses of heat and particles. The present work deals with the study of electrostatic micro-turbulence transport driven by instabilities of essentially two types: the io ...
The erosion, transport and deposition of tungsten in the outer divertor of JET-ILW has been studied for an H-Mode discharge with low frequency ELMs. For this specific case with an inter-ELM electron temperature at the strike point of about 20 eV, tungsten ...
ELSEVIER2019
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The possibility of performing electron density and temperature measurements in a high power helicon plasma is a crucial issue in the framework of the AWAKE (Advanced WAKefield Experiment) project, which demonstrates acceleration of particles using GeV m(-1 ...
2020
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Chemists continuously harvest the power of non-covalent interactions to control phenomena in both the micro- and macroscopic worlds. From the quantum chemical perspective, the strategies essentially rely upon an in-depth understanding of the physical origi ...
ROYAL SOC CHEMISTRY2019
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We present a first-principles approach to compute the transport properties of 2D materials in an accurate and automated framework. We use density-functional perturbation theory in the appropriate bidimensional setup with open-boundary conditions in the thi ...
