Search results for "CONI"
showing 10 items of 984 documents
Orbiting Orbitals: Visualization of Vi-Bronic Motion at a Conical Intersection
2013
The Jahn-Teller (JT) active unpaired electron of single metalloporphyrin radical anions is imaged through scanning tunneling microscopy. It is demonstrated that the electron is delocalized over the porphyrin macrocycle and its topographic image is determined by vibronic motion: the orbital of the electron adiabatically follows the zero-point pseudorotation of skeletal deformations. Transformation of the polar graphs of the observed images allows visualization of the adiabatic vibrational density to which the electron is coupled. The vibronic potential at the conical intersection is visualized and the half-integer angular momentum characteristic of the Berry phase is revealed in the radial f…
Excitation of Nucleobases from a Computational Perspective I: Reaction Paths
2013
The main intrinsic photochemical events in nucleobases can be described on theoretical grounds within the realm of non-adiabatic computational photochemistry. From a static standpoint, the photochemical reaction path approach (PRPA), through the computation of the respective minimum energy path (MEP), can be regarded as the most suitable strategy in order to explore the electronically excited isolated nucleobases. Unfortunately, the PRPA does not appear widely in the studies reported in the last decade. The main ultrafast decay observed experimentally for the gas-phase excited nucleobases is related to the computed barrierless MEPs from the bright excited state connecting the initial Franck…
Conversion of levulinic acid to γ-valerolactone over Zr-containing metal-organic frameworks: Evidencing the role of Lewis and Brønsted acid sites
2021
Zr-containing UiO-66 and MOF-808 are evaluated for converting levulinic acid (LA) into γ-valerolactone (GVL) through various routes: (i) Step-wise esterification of LA to n-butyl levulinate (nBuL) and Meerwein-Ponndorf-Verley (MPV) reduction to GVL; (ii) One-pot two-steps esterification with n-butanol followed by MPV reduction with sec-butanol; and (iii) direct conversion of LA into GVL through a tandem reaction. Selection of this multistep complex reaction evidences the participation of the different acid sites (Lewis or Brønsted) of the material in each individual step: Brønsted-induced acid sites catalyze esterification reaction efficiently, while Lewis acid sites are the preferred sites…
Iconicity in grammar chinese
2014
The notion of iconicity has become an interesting topic in the Western cognitive linguistics today. We chose to study the problem of iconicity in the context of Chinese grammar. Like any "ideographic" language, the Mandarin Chinese reveal a high degree of iconicity by his writing. In the history of Chinese linguistics, many studies have been done on the similarity between the form of the Chinese character and the sense which it represents. However, we only began to develop the notion of iconicity in the phonetic and syntactic domains with the introduction of cognitive linguistics in China thirty years ago. In this thesis, we will develop the notion of iconicity in the grammar of Chinese in …
Iconicity and semantics in sinographic typology
2022
From the 1980s, the notion of iconicity is frequently used in linguistics to describe the motivated relationship between the forms of the object and their meanings. Over the past hundred years, researchers from various countries have successively discovered iconic relationships between specific linguistic structures and structures of human experience, observable phenomena in various languages. As an ideographic script, linguistic studies always consider Chinese script as a special case compared to other scripts in linguistic study. Therefore, the problems of iconicity are mentioned much less regarding Chinese writing. In fact, by discovering the origin of the characters of this writing, we …
Variability of isozyme pattern, chromosome number, and latex colour and components in the closely related Papaver duhium L. and P. lecoqii Lamotte in…
1995
Summary The variability of nine different isozyme systems, chromosome number, colour of fresh and dried latex and presence or absence of meconic acid was investigated in altogether 45 populations of Papaver dubium and P. lecoqii mainly from C Europe. It was found that P. dubium is hexaploid with 2n = 42 chromosomes, has brown dried latex, and contains meconic acid. P. lecoqii is tetraploid with 2n = 28 chromosomes, has red dried latex, and lacks meconic acid. The two taxa can also be distinguished by differences in three of the nine isozymes analysed, and are almost completely monomorphic for their respective isozyme pattern. It is concluded that the two taxa, which cannot be reliably disti…
Occurrence of biomarkers of pesticide exposure in non-invasive human specimens.
2015
Biomonitoring has been used in many types of investigations, including national programmes and epidemiological studies, to explore the occurrence of biomarkers of pesticide exposure in the general population or relevant groups. This review discusses recent studies that measure levels of biomarkers of pesticide exposure in non-invasive human specimens such as urine, breast milk, meconium and hair. Specific and non-specific metabolites of organophosphate and pyrethroid insecticides have been widely investigated in urine, where some of the suitable biomarkers present rates of detection higher than 80%, which stand for an ongoing chronic exposure to traces of these chemicals. Hair is a promisin…
Autumn migration of soaring birds through the Gebel El Zeit Important Bird Area (IBA), Egypt, threatened by wind farm projects
2011
SummarySystematic bird observations were performed during autumn 2006 in the migration bottleneck area of Zeit Bay, Egypt (27.73°N, 33.51°E), situated on the coast of the Gulf of Suez, opposite southern Sinai. Owing to the strong northerly winds in that area, considerable pressure exists to construct wind farms. A total of 145,432 soaring birds, including 134,599 storks and 9,376 raptors over a period of 453.6 hours were observed between 20 August and 29 October by two teams working daily in two shifts. White Stork Ciconia ciconia and European Honey Buzzard Pernis apivorus were the most numerous species (91.4% and 5.7% respectively) of all soaring birds observed. As both species migrate ear…
Diastereoselective Insertion of Isocyanide into the Alkyl−Metal Bond of Methylbenz[ e ]indenyl ansa ‐Zirconocene Complexes
2004
Alkylation of ansa-zirconocene [Zr{(η5-C5H5)SiMe2(MBI)}Cl2] (MBI = η5-2-Me−C13H7) with MgRCl gave the dimethyl complex [Zr{(η5-C5H5)SiMe2(MBI)}Me2], but unresolvable mixtures containing mono-alkylated compounds were obtained when bulkier alkyls were used. However pure dialkyl complexes [Zr{(η5-C5H5)SiMe2(MBI)}R2] (R = CH2Ph, CH2SiMe3) were easily obtained using K(CH2Ph) and Li(CH2SiMe3) as alkylating agents. Diastereoselective insertion into the MBI-unprotected Zr−R bond was observed when all of these dialkyl complexes were treated with 2,6-xylyl isocyanide to give the iminoacyl compounds [Zr{(η5-C5H5)SiMe2(MBI)}R{CR[η2-N-(2,6-xylyl)]}] (R = Me, CH2Ph, CH2SiMe3). All of the new complexes we…
MoSi2 laser cladding—elaboration, characterisation and addition of non-stabilized ZrO2 powder particles
2003
International audience; The cladding process using laser beam radiation comprises different operational regimes, depending on the involved lasers (usually CO2 or Nd:YAG) and materials. A series of experiments has been carried out to investigate Nd:YAG laser cladding using MoSi2 powder. Procedures and operating parameters for producing clad layers has been developed and their properties evaluated. The feasibility of the laser cladding technique, using a high power Nd:YAG laser, by projecting MoSi2 powder on steel substrate was demonstrated. The results indicate a low density of cracks, elevated powder catchment efficiency (between 65 and 90%) and hardness values around 1200–1300 HV. Our goal…