Publications related to Ab initio study of water dissociation on a charged Pd(111) surface

Related publications (11)

Representing and machine learning complex electronic-structure properties of materials

The rise of high-throughput first-principles calculations of materials since the turn of the millennium has gifted the fields of physics, quantum chemistry, and materials science with a mountainous and ever-growing pile of data ready to be mined for hidden ...

EPFL2025

pH drives electron density fluctuations that enhance electric field-induced liquid flow

Sylvie Roke, Saranya Pullanchery Sankara Narayanan, Sergey Kulik, Tereza Schönfeldová

Liquid flow along a charged interface is commonly described by classical continuum theory, which represents the electric double layer by uniformly distributed point charges. The electrophoretic mobility of hydrophobic nanodroplets in water doubles in magni ...

Springer Science and Business Media LLC2024

Induced polarization imparts piezoelectricity in noncrystalline polymer films

Dragan Damjanovic

Piezoelectric materials produce a linear deformation in response to an applied electric field and are essential for precision-control devices. The conventional view is that polymers must be crystalline and possess remanent polarization after artificial pol ...

American Physical Society (APS)2024

Anchoring CoTiO3/TiO2 heterostructure on fiber network actuates flow-through Fenton-like oxidation: Electronic modulation and rapid pollutants degradation

Junwu Chen

Versatile catalytic oxidation filtration system, especially under low operating pressure conditions, is a frontier technology for organic wastewater purification. Herein, CoTiO3/TiO2 heterostructure was anchored on fiber network (CTO/TOF) to actuate flow-t ...

Elsevier2024

SPLEND1D, a reduced one-dimensional model to investigate the physics of plasma detachment

Christian Gabriel Theiler, Olivier Claude Martin Février, Sophie Danielle Angelica Gorno, Garance Hélène Salomé Durr-Legoupil-Nicoud, Massimo Carpita, Kim Dimuth Von Allmen

Studying the process of divertor detachment and the associated complex interplay of plasma dynamics and atomic physics processes is of utmost importance for future fusion reactors. While simplified analytical models exist to interpret the general features ...

American Institute of Physics (AIP)2024

Photostrictive Actuators Based on Freestanding Ferroelectric Membranes

Luis Guillermo Villanueva Torrijo, Daniel Moreno Garcia

Complex oxides offer a wide range of functional properties, and recent advances in the fabrication of freestanding membranes of these oxides are adding new mechanical degrees of freedom to this already rich functional ecosystem. Here, photoactuation is dem ...

Wiley-V C H Verlag Gmbh2024

III-N Optoelectronic Devices: Understanding the Physics of Electro-Optical Degradation

Nicolas Grandjean, Jean-François Carlin, Camille Haller

III-N optoelectronic devices are of great interest for many applications. Visible emitters (based on InGaN) are widely used in the lighting, display and automotive fields. Ultraviolet LEDs (based on AlGaN) are expected to be widely used for disinfection, m ...

SPIE2023

Fast dynamic 1D simulation of divertor plasmas with neural PDE surrogates

Yoeri Renier Johannes Poels

Managing divertor plasmas is crucial for operating reactor scale tokamak devices due to heat and particle flux constraints on the divertor target. Simulation is an important tool to understand and control these plasmas, however, for real-time applications ...

IOP Publishing Ltd2023

An improved subthreshold swing expression accounting for back-gate bias in FDSOI FETs

Christian Enz, Farzan Jazaeri, Hung-Chi Han

In a MOSFET transistor, the subthreshold swing defines the switching efficiency, and the associated slope factor, or so-called body factor, is a critical parameter in charge-based models. However, in an advanced Fully -Depleted Silicon-On-Insulator (FDSOI) ...

PERGAMON-ELSEVIER SCIENCE LTD2023

Self-consistent gyrokinetic modeling of turbulent and neoclassical tungsten transport in toroidally rotating plasmas

Kyungtak Lim

The effect of toroidal rotation on both turbulent and neoclassical transport of tungsten (W) in tokamaks is investigated using the flux-driven, global, nonlinear 5D gyrokinetic code GYSELA. Nonlinear simulations are carried out with different levels of mom ...

2023

Intrinsic thermal stability of inverted perovskite solar cells based on electrochemical deposited PEDOT

Jing Gao

Thermal stability of perovskite materials is an issue impairing the long-term operation of inverted per-ovskite solar cells (PSCs). Herein, the thermal attenuation mechanism of the MAPbI3 films that deposited on two different hole transport layers (HTL), p ...

ELSEVIER2023