نتایج جستجو برای: polarized continuum model

تعداد نتایج: 2165174  

Journal: :Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 2015
Tao Wang Xueliang Wang

The title compounds, rabdosinate and rabdosin B, were isolated from the leaves of Isodon japonica, and characterized by IR-NMR spectroscopy. The molecular geometry, vibrational frequencies and gauge including atomic orbital (GIAO-13C) chemical shift values of the title compounds have been calculated by using DFT/B3LYP method with 6-311++G(d,p) basis set. In addition, obtained results were relat...

Journal: :Physical review letters 2002
G Baskaran S A Jafari

Using the standard tight binding model of 2D graphite with short range electron repulsion, we predict a gapless spin-1, neutral collective mode branch below the particle-hole continuum with energy vanishing linearly with momenta at the Gamma and K points in the Brillouin zone. This spin-1 mode has a wide energy dispersion, 0 to approximately 2 eV, and is not Landau damped. The "Dirac cone spect...

2011
W. W. Jacobs

The continuum cross sections and analyzing powers from the H, ' He( p, p') and ' He( p, d') reactions were measured for 98.7 and 149.3 MeV polarized protons in the angular range 17.5 to 60'. The H and 'He data show strong quasifree contributions with more ambiguous results for He. These data are compared with distorted-wave impulse approximation calculations based on quasifree nucleon and deute...

Journal: :Molecules 2014
Eveline M Bezerra João R Bezerra-Neto Francisco A M Sales Ricardo P dos Santos Alice M C Martins Pedro de Lima-Neto Ewerton W S Caetano Eudenilson L Albuquerque Valder N Freire

UV-vis optical absorption spectra of the antitrypanocidal drug benznidazole solvated in water were measured for various concentrations. The spectra show a prominent peak around 3.80 eV, while deconvolution of the UV-vis optical absorption spectra revealed six bands centered at 3.60, 3.83, 4.15, 4.99, 5.60, and 5.76 eV. Benznidazole electronic transitions were obtained after density functional t...

and J. Parvizian, M. Mashayekhi, S. Ziaei-Rad,

The continuum mechanic simulation of micro-structural damage process is important in the study of ductile fracture mechanics. In this paper, the continuum damage mechanics model formulation proposed by Lematire has been validated against ductile damage evolution experimentally measured in A533B-C1 steel under stress triaxiality conditions. First, a &#10procedure to identify the model parameters...

and J. Parvizian, M. Mashayekhi, S. Ziaei-Rad,

The continuum mechanic simulation of micro-structural damage process is important in the study of ductile fracture mechanics. In this paper, the continuum damage mechanics model formulation proposed by Lematire has been validated against ductile damage evolution experimentally measured in A533B-C1 steel under stress triaxiality conditions. First, a procedure to identify the model parameters f...

2004
Maik Wolleben Wolfgang Reich

Maps of Galactic polarized continuum emission at 1408, 1660, and 1713 MHz towards the local Taurus molecular cloud complex were made with the Effelsberg 100-m telescope. Minima in the polarized emission which are located at the boundary of a molecular cloud were detected. Beside high rotation measures and unusual spectral indices of the polarized intensity, these features are associated with th...

Journal: :iranian biomedical journal 0
معرفت غفاری نوین marefat ghaffari novin محمد نوری mohammad nouri

the importance of extra cellular matrix (ecm) in development and function of different cells has been reported but little is known about its role in human endometrial epithelial cells. the aim of the present study was to examine effects of artificial ecm (matrigel) and progesterone on the function and morphology of human endometrial epithelial cells in vitro. methods: endometrial samples were r...

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه لرستان - دانشکده علوم پایه 1389

abstract part one: the electrode oxidation potentials of a series of eighteen n-hydroxy compounds in aqueous solution were calculated based on a proper thermodynamic cycle. the dft method at the level of b3lyp-6-31g(d,p) was used to calculate the gas-phase free energy differences ,and the polarizable continuum model (pcm) was applied to describe the solvent and its interaction with n-hydroxy ...

Journal: :The Astrophysical Journal 2022

Thomson scattered photospheric light is the dominant constituent of lower solar corona's spectral continuum viewed off-limb at optical wavelengths. Known as K-corona, it also linearly polarized. We investigate possibility using a priori polarized characteristics together with emission lines, to measure and correct instrument-induced crosstalk. First, we derive Stokes parameters scattering unpol...

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