Publications related to Hydration dynamics and IR spectroscopy of 4-fluorophenol

Related publications (19)

WST - Widefield Spectroscopic Telescope: addressing the instrumentation challenges of a new 12m class telescope dedicated to widefield Multi-object and Integral Field Spectroscopy

Jean-Paul Richard Kneib, Ricardo Jorge Araùjo Pereira, Maxime François Pierre Maurice Rombach

WST - Widefield Spectroscopic Telescope: We summarise the design challenges of instrumentation for a proposed 12m class Telescope that aims to provide a large (>2.5 square degree) field of view and enable simultaneous Multi-object (> 20,000 objects) and In ...

SPIE2024

Dissecting the hydrogen bond network of water: Charge transfer and nuclear quantum effects

Sylvie Roke, David Mark Wilkins, Mischa Samuel Flór

The molecular structure of water is dynamic, with intermolecular hydrogen (H) bond interactions being modified by both electronic charge transfer and nuclear quantum effects (NQEs). Electronic charge transfer and NQEs potentially change under acidic or bas ...

American Association for the Advancement of Science2024

Control of excited state charge transfer dynamics of DMABN in deep eutectic solvent: Involvement of the partially twisted intermediate state

Ursula Röthlisberger, Swarnendu Bhattacharyya

The photo-driven charge transfer process of 4-(dimethylamino) benzonitrile (DMABN) in deep eutectic solvent (DES) is investigated through steady state and time resolved spectroscopy along with non -adiabatic molecular dynamic simulations. Simultaneous coex ...

ELSEVIER2023

Monolithic InSb nanostructure photodetectors on Si using rapid melt growth

Anna Fontcuberta i Morral, Nicholas Paul Morgan

Monolithic integration of InSb on Si could be a key enabler for future electronic and optoelectronic applications. In this work, we report the fabrication of InSb metal-semiconductor-metal photodetectors directly on Si using a CMOS-compatible process known ...

ROYAL SOC CHEMISTRY2023

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

A Nearly Zero-Strain Li-Rich Rock-Salt Oxide with Multielectron Redox Reactions as a Cathode for Li-Ion Batteries

Corsin Battaglia, Chunyang Zhang, Xiao Liu

Li-rich oxide cathodes are drawing increasing attention as next-generation cathode materials for the development of high-energy-density Li-ion batteries due to their strikingly high capacities. However, transition-metal migration, irreversible structural p ...

AMER CHEMICAL SOC2022

Accurate and efficient band-gap predictions for metal halide perovskites at finite temperature

Alfredo Pasquarello, Patrick Gono, Thomas Bischoff, Haiyuan Wang

We develop a computationally efficient scheme to accurately determine finite-temperature band gaps for metal halide perovskites belonging to the class ABX(3) (A = Rb, Cs; B = Ge, Sn, Pb; and X = F, Cl, Br, I). First, an initial estimate of the band gap is ...

NATURE PORTFOLIO2022

FKN Formula and Ground State Energy for the Spin Boson Model with External Magnetic Field

Oliver Siebert

We consider the spin boson model with external magnetic field. We prove a path integral formula for the heat kernel, known as Feynman-Kac-Nelson (FKN) formula. We use this path integral representation to express the ground state energy as a stochastic inte ...

SPRINGER INT PUBL AG2022

Structural characterisation of nanoalloys for (photo)catalytic applications with the Sapphire library

Kevin Rossi

A non-trivial interplay rules the relationship between the structure and the chemophysical properties of a nanoparticle. In this context, characterization experiments, molecular dynamics simulations and electronic structure calculations may allow the varia ...

ROYAL SOC CHEMISTRY2022

Spatially Controlled Activation of Toll-like Receptor 9 with DNA-Based Nanomaterials

Maartje Martina Cornelia Bastings, Alice Comberlato, Marianna Mainardi Koga

First evidence of geometrical patterns and defined distances of biomolecules as fundamental parameters to regulate receptor binding and cell signaling have emerged recently. Here, we demonstrate the importance of controlled nanospacing of immunostimulatory ...

AMER CHEMICAL SOC2022

Study of charmonium and charmonium-like contributions in B+ -> J/psi eta K+ decays

Olivier Schneider, Aurelio Bay, Guido Haefeli, Tatsuya Nakada, Frédéric Blanc, Lesya Shchutska, Elena Graverini, Vladimir Macko, Sebastian Schulte, Donal Patrick Hill, Maria Vieites Diaz, Marie Theres Christin Bachmayer, Lino Ferreira Lopes, Matthieu Philippe Luther Marinangeli, Serhii Cholak, Veronica Sølund Kirsebom, Ettore Zaffaroni, Surapat Ek-In, Ana Bárbara Rodrigues Cavalcante, Sara Celani, Renato Quagliani, Carina Trippl, Sonia Amina Bouchiba, Alison Maria Tully, Elisabeth Maria Niel, Maarten Willibrord Uriël Van Dijk

A study of B+ -> J/psi eta K+ decays, followed by J/psi -> mu(+)mu(-) and eta -> gamma gamma, is performed using a dataset collected with the LHCb detector in proton-proton collisions at centre-of-mass energies of 7, 8 and 13 TeV, corresponding to an integ ...

Springer Nature2022

On the relevance of P poisoning in real-world DOC aging

Oliver Kröcher, Davide Ferri

Understanding the real aging of Diesel oxidation catalysts (DOC) is key to predict their useful lifetime. This work comprises a detailed study of a commercial DOC in its unused state and after use in vehicle for 288,000 km. The activity of the samples was ...

ELSEVIER2021

Ultrafast electron localization in the EuNi2(Si0.21Ge0.79)(2) correlated metal

Giulia Fulvia Mancini, Jérémy Raymond Jean Maurice Rouxel

Ultrafast electron delocalization induced by a femtosecond laser pulse is a well-known process in which electrons are ejected from the ions within the laser pulse duration. However, very little is known about the speed of electron localization out of an el ...

AMER PHYSICAL SOC2021

Cavity-assisted preparation and detection of a unitary Fermi gas

Jean-Philippe Brantut, Victor Youri Helson, Kevin Etienne Robert Roux, Hideki Konishi

We report on the fast production and weakly destructive detection of a Fermi gas with tunable interactions in a high finesse cavity. The cavity is used both with far off-resonant light to create a deep optical dipole trap, and with near-resonant light to r ...

2021

Optical absorption properties of metal-organic frameworks: solid stateversusmolecular perspective

Berend Smit, Anne-Clémence Corminboeuf, Ivano Tavernelli, Maria Fumanal Quintana

The vast chemical space of metal and ligand combinations in Transition Metal Complexes (TMCs) gives rise to a rich variety of electronic excited states with local and non-local character such as intra-ligand (IL), metal-centered (MC), metal-to-ligand (MLCT ...

2020

Dissipative-coupling-assisted laser cooling: Limitations and perspectives

Alexander Tagantsev

The recently identified possibility of ground-state cooling of a mechanical oscillator in the unresolved sideband regime by combination of the dissipative and dispersive optomechanical coupling under the red sideband excitation [Phys. Rev. A 88, 023850 (20 ...

AMER PHYSICAL SOC2020

Ring a ring o' pulses

Johann Emmeram Riemensberger

Quantum cascade lasers are bright and compact semiconductor lasers that emit light in the mid- to far-infrared spectral region. The use of a closed ring cavity has now set them on the path towards ultrafast pulses. ...

NATURE PUBLISHING GROUP2020

First-order Neel to columnar valence bond solid transition in a model square-lattice S=1 antiferromagnet

Jonathan D'Emidio

We study the Neel to fourfold columnar valence bond solid (cVBS) quantum phase transition in a sign-free S = 1 square-lattice model. This is the same kind of transition that for S = 1/2 has been argued to realize the prototypical deconfined critical point. ...

AMER PHYSICAL SOC2020

Electrons leave the flatland: out-of-plane charge dynamics in layered materials

Edoardo Martino

The goal of this thesis is to explore the "neglected" third dimension of layered materials, by studying the interlayer charge dynamics through dc conductivity, optical spectroscopy and ab-initio calculations. This project was designed to respond to the gro ...

EPFL2020