Search results for "SPECTRA"
showing 10 items of 3542 documents
Line broadening coefficient calculations for methane perturbed by nitrogen
2010
Abstract We report semiclassical line broadening calculations for methane perturbed by nitrogen at room temperature. For this, we have developed a symmetrized version of the Robert and Bonamy theory. The interaction potential was built from electrostatic (octopole and hexadecapole for methane, quadrupole for nitrogen) and atom–atom contributions. The relative (classical) trajectories of the molecules were computed in the frame of the usual parabolic model, through analytical formula. High orders of developments had to be used for the short range molecular interactions. As a consequence, a combination of symbolic computation and source code generation was employed to implement practical calc…
Unbounded Linear Operators in Hilbert Spaces
2002
In order to make this monograph self-contained, we summarize in this chapter some basic definitions and results for unbounded linear operators in a Hilbert space. In Section 1.1, we recall the definitions of C*-algebras and von Neumann algebras. In Section 1.2, we define and investigate the notion of closedness, the closure and the adjoint of an unbounded linear operator in a Hilbert space. Section 1.3 is devoted to the Cayley transform approach to the self-adjointness of a symmetric operator. Section 1.4 deals with the self-adjoint extendability of a symmetric operator with help of the deficiency spaces. In Section 1.5, we extend to unbounded self-adjoint operators the spectral theorem and…
Untersuchungen zur Zeitstruktur pathologischer Sprachproduktion
1996
Ein einfaches Screening-Verfahren wird vorgestellt, mit dessen Hilfe es moglichist, Sprechstorungen zu bewerten. Mittels eines Algorithmus werden die digitalisierten Sprechsignale zeitnormiert und wir
Nature of the asymmetry in the hydrogen-bond networks of hexagonal ice and liquid water.
2014
The interpretation of the X-ray spectra of water as evidence for its asymmetric structure has challenged the traditional nearly tetrahedral model and initiated an intense debate about the order and symmetry of the hydrogen-bond network in water. Here, we present new insights into the nature of local interactions in ice and liquid water obtained using a first-principle energy decomposition method. A comparative analysis shows that the majority of molecules in liquid water in our simulation exhibit hydrogen-bonding energy patterns similar to those in ice and retain the four-fold coordination with only moderately distorted tetrahedral configurations. Although this result indicates that the tra…
Chasing Shakespeare: The Impurity of the “Not Quite” in Norry Niven’s From Above and Abbas Kiarostami’s Where Is My Romeo
2017
The essay situates the “not Shakespeare” of this volume within the theoretical problematics of the “post-textual.” It re-elaborates the “post-textual” as the uncanny re-appearance of Shakespeare in the form of heterogeneous fragments that are made to cohabit with various textual and media environments. These media products include a “Shakespeare” that is not quite Shakespeare, an “entity” that becomes the site of unceasing transactions (for instance, between an “outside” and an “inside,” between visibility and invisibility, between the “original” and its iteration) and multiple contaminations (through media, characters, and plays).
Synthesis and characterization of lithocholic acid derived dipyrromethanes: precursors for pyrrole-steroidal macrocycles
2004
Abstract Three steroidal dipyrromethanes, 3,3,24,24-tetrakis(pyrrol-2-yl)-5β-cholane 1 , 3,3-bis(pyrrol-2-yl)-5β-cholan-24-oic acid 2 , and methyl 3,3-bis(pyrrol-2-yl)-5β-cholan-24-oate 3 , have been prepared from 3α-hydroxy-5β-cholan-24-oic acid (lithocholic acid) 4 in good overall yields. The structures of 1 – 3 have been fully characterized by 1 H, 13 C, PFG DQF 1 H– 1 H COSY, 1 H– 1 H ROESY, 13 C DEPT-135, PFG 1 H– 13 C HMQC, PFG 1 H– 13 C HMBC, and PFG 1 H– 15 N HMBC NMR spectra. Their molecular weights and compositions have been determined by ESI-TOF and EI mass spectra, and elemental analyses. The energetically optimised geometry and isotropic 13 C NMR chemical shifts of 3,3,24,24-te…
Dynamic best spectral bands selection for face recognition
2014
In this paper, face recognition in uncontrolled illumination conditions is investigated. A twofold contribution is proposed. First, three state-of-art algorithms, namely Multiblock Local Binary Pattern (MBLBP), Histogram of Gabor Phase Patterns (HGPP) and Local Gabor Binary Pattern Histogram Sequence (LGBPHS) are evaluated upon the IRIS-M3 face database to study their robustness against a high illumination variation conditions. Second, we propose to use visible multispectral images, provided by the same face database, to enhance the performance of the three mentioned algorithms. To reduce the high data dimensionality introduced by the use of multispectral images, we have designed a system t…
Photoionization of adsorbates on sites with non-axial local symmetry. An example of the symmetry group
1996
We present an analysis of the influence of the local adsorption site symmetry on the angular distribution of photoelectrons ejected from adsorbed atoms or molecules. This analysis applies to photoelectron spectra obtained with photons of any energy in the VUV (photoelectron spectroscopy) or x-ray (XPS) regions, provided that the associated wave of the electron `sees' the neighbouring surface atoms. The adsorbate - substrate system is modelled by a cluster of symmetry group consisting of an adsorbate and several atoms of the substrate. The analysis applies also to clean surfaces of symmetry and to molecules of the symmetry group fixed in space. This local symmetry analysis is an alternative …
The oxidation state of iron in silicic melt at 500 MPa water pressure
2002
Abstract The dependence of the ferric–ferrous ratio in silicate melts on oxygen fugacity was studied in the system SiO2(Qz)–NaAlSi3O8(Ab)–CaAl2Si2O8(An)–H2O using Mossbauer spectroscopy. Experiments were performed under water-saturated conditions at 500 MPa, and at temperatures of 850 and 950 °C, covering a range typical for magmatic processes. The oxygen fugacity was varied in the fO2 range from Cu–Cu2O buffer to slightly more reducing conditions than the wustite–magnetite buffer. The iron redox ratio was determined by analyzing the Mossbauer parameter distribution that was modeled based on experimental spectra collected at room temperature on the quenched samples. The obtained iron redox …
Tunneling luminescence in long lasting afterglow of SrAl 2 O 4 :Eu,Dy
2017
The publication is prepared with the financial support of National Research Programme IMIS2.