Search results for "Configuration"
showing 10 items of 601 documents
CQ*-Algebras of Operators and Application to Quantum Models
2000
C*-algebras constitute, as known, the cornerstones of the Haag-Kastler [1] algebraic approach to quantum systems, with infinitely many degrees of freedom: one usually starts, in fact, with associating to each bounded region V of the configuration space of the system the C*-algebra A v of local observables in V. The uniform completion A of the algebra A0 generated by the Av’s is then considered as the C*-algebra of observables of the system.
Two-way automata with multiplicity
2005
We introduce the notion of two-way automata with multiplicity in a semiring. Our main result is the extension of Rabin, Scott and Shepherdson's Theorem to this more general case. We in fact show that it holds in the case of automata with multiplicity in a commutative semiring, provided that an additional condition is satisfied. We prove that this condition is also necessary in a particular case. An application is given to zig-zag codes using special two-way automata.
Coordinates for quasi-Fuchsian punctured torus space
1998
We consider complex Fenchel-Nielsen coordinates on the quasi-Fuchsian space of punctured tori. These coordinates arise from a generalisation of Kra's plumbing construction and are related to earthquakes on Teichmueller space. They also allow us to interpolate between two coordinate systems on Teichmueller space, namely the classical Fuchsian space with Fenchel-Nielsen coordinates and the Maskit embedding. We also show how they relate to the pleating coordinates of Keen and Series.
Theoretical study of excitation transfer from modified B800 rings of the LH II antenna complex of Rps. acidophila
2002
The recently developed configuration interaction exciton model has been applied to study spectral shifts and B800 to B850 energy transfer rates in a series of modified LH2 light harvesting antenna complexes of the purple bacterium Rhodopseudomonas acidophila. Complexes, where the in vivo B800 bacteriochlorophyll a chromophores are exchanged with different tetrapyrroles including chlorophyll a were studied. Absorption spectra of the modified complexes were simulated by using quantum chemical methods to evaluate site and interaction energies and exciton theory to generate the eigenstates of the chromophore assemblies. Four experimental input parameters: the transition moment of Bchl a, the di…
Crystal structure of (1S,2R,4S)-1-[(morpholin-4-yl)methyl]-4-(prop-1-en-2-yl)cyclohexane-1,2-diol
2014
Besides intramolecular O—H⋯N hydrogen bonds, the crystal structure displays intermolecular O—H⋯O and C—H⋯O hydrogen bonds linking the molecules into undulating layers parallel to the (01) plane.
Perthamides C-F, potent human antipsoriatic cyclopeptides
2011
Abstract Two new cyclopeptides, perthamides E and F were isolated from the polar extracts of the sponge Theonella swinhoei . The new structures, featuring an unprecedented β-amino acid unit (AHMOA), were determined by interpretation of NMR and MS data. The absolute configuration of the AHMOA residue was proposed on the basis of quantum chemical calculation of NMR chemical shifts. Perthamides were proved to inhibit TNF-α and IL-8 release in primary human keratinocytes cells and therefore could represent potentially leads for the treatment of psoriasis.
Tuning the Kondo resonance in two-dimensional lattices of cerium molecular complexes
2018
International audience; Cerium intermetallics have raised a lot of interest for the past forty years thanks to their very unusual and interesting electronic and magnetic properties. This can be explained by the peculiar electronic configuration of Ce (4f1) that allows different oxidation states leading to singular behavior such as quantum phase transitions, heavy-fermion behavior and the Kondo effect. In this work, we used a mixed-valence molecular analogue to study the Kondo effect down to the atomic scale by means of scanning tunneling microscopy/spectroscopy (STM/STS) for which new many-body effects are expected to emerge due to reduced dimensionality and specific chemical environment of…
Calculating loops without loop calculations: Next-to-leading order computation of pentaquark correlators
2012
We compute next-to-leading order (NLO) perturbative QCD corrections to the correlators of interpolating pentaquark currents and their absorptive parts. We employ modular techniques in configuration space which saves us from the onus of having to do loop calculations. The modular technique is explained in some detail. We present explicit NLO results for several interpolating pentaquark currents that have been written down in the literature. Our modular approach is easily adapted to the case of NLO corrections to multiquark correlators with an arbitrary number of quarks/antiquarks.
Palladium-catalysed direct cross-coupling of secondary alkyllithium reagents
2014
Palladium-catalysed cross-coupling of secondary C(sp(3)) organometallic reagents has been a long-standing challenge in organic synthesis, due to the problems associated with undesired isomerisation or the formation of reduction products. Based on our recently developed catalytic C-C bond formation with organolithium reagents, herein we present a Pd-catalysed cross-coupling of secondary alkyllithium reagents with aryl and alkenyl bromides. The reaction proceeds at room temperature and on short timescales with high selectivity and yields. This methodology is also applicable to hindered aryl bromides, which are a major challenge in the field of metal catalysed cross-coupling reactions.
Crystal structure determination of 1-pentanol from low-temperature powder diffraction data by Patterson search methods
2005
5 pages.-- PACS: 61.66.Hq; 61.50.Lt