Publications associées à Oxohalogénure

Substantial contribution of iodine to Arctic ozone destruction

Julia Schmale, Ivo Fabio Beck, Hélène Paule Angot, Lubna Dada

Unlike bromine, the effect of iodine chemistry on the Arctic surface ozone budget is poorly constrained. We present ship-based measurements of halogen oxides in the high Arctic boundary layer from the sunlit period of March to October 2020 and show that io ...

2022

Renewable monomer and polymer thereof

Jeremy Luterbacher, Lorenz Perry Manker, Stefania Bertella, Graham Reid Dick

Described is a compound having the structure (I), (II) or (V), Formulae(I), (II), (V), wherein R1 is -H, -CH2OH or -CH(OH)CH2OH; R2 is -H, -OH, or -CH2OH; R3 is -H, -OH, or -CH2OH; n is 0 or 1; p is 0 or 1; R10 is hydrogen or a hydrocarbon moiety with 1 to ...

2021

Using collective knowledge to assign oxidation states of metal cations in metal-organic frameworks

Berend Smit, Seyedmohamad Moosavi, Daniele Ongari, Kevin Maik Jablonka

Knowledge of the oxidation state of metal centres in compounds and materials helps in the understanding of their chemical bonding and properties. Chemists have developed theories to predict oxidation states based on electron-counting rules, but these can f ...

NATURE RESEARCH2021

Radial Spin Texture of the Weyl Fermions in Chiral Tellurium

Majed Chergui, Henrik Moodysson Rønnow, Marco Grioni, Oleg Yazyev, Luc Testa, Daniel Gosalbez Martinez, Michele Puppin, Philippe Bugnon, Luca Moreschini, Alberto Crepaldi, Mauro Fanciulli, Gianmarco Gatti, Simon Karl Moser, Edoardo Martino, Silvan Dino Marcos Roth, Serhii Polishchuk

Trigonal tellurium, a small-gap semiconductor with pronounced magneto-electric and magneto-optical responses, is among the simplest realizations of a chiral crystal. We have studied by spin- and angle-resolved photoelectron spectroscopy its unconventional ...

AMER PHYSICAL SOC2020

Evaluation of materials for iodine and technetium immobilization through sorption and redox-driven processes

Wendy Lee Queen, Daniel Teav Sun

Radioactive iodine-129 (I-129) and technetium-99 (Tc-9(9)) pose a risk to groundwater due to their long half-lives, toxicity, and high environmental mobility. Based on literature reviewed in Moore et al. (2019) and Pearce et aL (2019), natural and engineer ...

ELSEVIER2020

Theoretical Investigation of the Electronic Structure and Magnetic Properties of Oxo-Bridged Uranyl(V) Dinuclear and Trinuclear Complexes

Marinella Mazzanti

The uranyl(V) complexes UO2(dbm)(2)K(18C6) (dbm = dibenzoylmethanate) and UO2(L)(L = 2-(4-tolyl)-1,3-bis(quinolyl)malondiiminate), exhibiting diamond-shaped U2O2 and triangular-shaped U3O3 cores respectively with 5f(1)-5f(1 )and 5f(1)-5f(1)-5f(1) ...

2019

Unexpected Insights about Cation-Exchange on Metal Oxide Nanoparticles and Its Effect on Their Magnetic Behavior

Davide Deiana

Tuning the magnetic behavior of nanoparticles via the control of their features has always been challenging because these features are mostly intertwined. In the last years, a novel synthetic approach based on cation-exchange has been reported, and one of ...

AMER CHEMICAL SOC2018

First-principles calculations of momentum distributions of annihilating electron-positron pairs in defects in UO2

Julia Anna Wiktor

We performed first-principles calculations of the momentum distributions of annihilating electron-positron pairs in vacancies in uranium dioxide. Full atomic relaxation effects (due to both electronic and positronic forces) were taken into account and self ...

Iop Publishing Ltd2017

Direct Evaluation of the Hyperconjugative Interactions in 1,1,1-Trihaloethane (CH3CX3, X = F, Cl, and Br)

Anne-Clémence Corminboeuf, Zhenhua Chen

Following the computational strategy proposed by Mulliken in 1939 (J. Chem. Phys. 1939, 7 (5), 339-352), when the concept of hyperconjugation was coined, we evaluated the hyperconjugative stabilization energy in 1,1,1-trihaloethane using the block-localize ...

Amer Chemical Soc2014

Speciation of aqueous tellurium(IV) in hydrothermal solutions and vapors, and the role of oxidized tellurium species in Te transport and gold deposition

Lothar Helm, Pascal Grundler

Despite the close association between tellurium (Te) and gold (Au) in many epithermal, orogenic, and intrusion-related hydrothermal ore deposits, the hydrothermal chemistry of Te remains poorly understood. We studied the protonation/ deprotonation and stru ...

Elsevier2013

Multiferroicity in the geometrically frustrated FeTe2O5Cl

Helmuth Berger

The layered FeTe2O5Cl compound was studied by specific-heat, muon-spin relaxation, nuclear magnetic resonance, and dielectric as well as neutron and synchrotron x-ray diffraction measurements, and the results were compared to isostructural FeTe2O5Br. We fi ...

Amer Physical Soc2013

Crystal Structure and Magnetic Properties of Two New Antiferromagnetic Spin Dimer Compounds; FeTe3O7X (X = Cl, Br)

Jia Liu, Helmuth Berger, Dong Zhang

Two new isostructural layered oxohalides FeTe3O7X (X = Cl, Br) were synthesized by chemical vapor transport reactions, and their crystal structures and magnetic properties were characterized by single-crystal X-ray diffraction, Raman spectroscopy, magnetic ...

2011

Reactive Chemical Doping of the Bi2Se3 Topological Insulator

Klaus Kern

Using angular resolved photoemission spectroscopy we studied the evolution of the surface electronic structure of the topological insulator Bi2Se3 as a function of water vapor exposure. We find that a surface reaction with water induces a band bending, whi ...

2011

Spin resonance in the ordered magnetic state of Ni-5(TeO3)(4)Cl-2

László Forró, Helmuth Berger, Bálint Náfrádi

The transition metal tellurium oxychloride, Ni-5(TeO3)(4)Cl-2, has been investigated by high-field electron-spin resonance for frequencies up to 3 THz, at temperatures well below the magnetic ordering at 23 K. At zero external field several resonance modes ...

2006

Preparation of stable AsBr4+ and I2As-PI3+ salts. Why didn't we succeed to prepare AsI4+ and As2X5+? A combined experimental and theoretical study

In analogy to the authors' successful PX2+ insertion reactions, an AsX2+ insertion route was explored to obtain new arsenic halogen cations. Two new salts were prepd.: AsBr4+[Al(OR)4]-, starting from AsBr3, Br2 and Ag[Al(OR)4], and I2As-PI3+[Al(OR)]4 from ...

2005

The gas phase acidity of oligofluorobenzenes and oligochlorobenzenes: about the additivity or non-additivity of substituent effects

Fabrice Cottet

The deprotonation energies of benzene, fluorobenzene, all di-, tri-, and tetrafluorobenzenes, pentafluorobenzene, chlorobenzene, all di-, tri-, and tetrachlorobenzenes, and pentachlorobenzene have been calcd. at various levels of second-order Moller-Plesse ...

2005