The oxidation state of chromium in glasses melted in an air atmosphere with and without refining agents was investigated by Cr K-edge X-ray Absorption Near-Edge Structure (XANES) and optical absorption spectroscopy. A good agreement in the relative proportion of Cr(III) and Cr(VI) is obtained between both methods. We show that the chemical dependence of the absorption coefficient of Cr(III) is ...

we report the growth by ion exchange synthesis of zns nanoparticles in mcm-41 matrices using zn (ch3coo)2 and na2s starting sources. the final product (zns/mcm-41) was characterized by x-ray diffraction (xrd) pattern, transmission electron microscopy (tem), scanning electron microscopy (sem), infrared spectrometry (ir) and uv-vis spectroscopy. its crystalline structure and morphology was studie...

Cytochrome P450 enzymes are an important family of biocatalysts that oxidize chemically inert CH bonds. There are many unresolved questions regarding the catalytic reaction intermediates, in particular P450 Compound I (Cpd-I) and II (Cpd-II). By using simple molecular models, we simulate various X-ray spectroscopy signals, including X-ray absorption near-edge structure (XANES), resonant inelas...

Monoclinic-scheelite BiVO4 has been widely studied as a promising oxygen evolution reaction (OER) catalyst in artificial photosynthesis. Though significant progress to improve or augment its catalysis performance has been made, fundamental understanding of its relatively poor performance as a bare material is lacking. In this paper, we report the correlation of the surface structure and trap st...

A novel zinc oxide - agar nanocomposite was successfully synthesized using zinc chloride as a precursor. The nanocomposite was prepared using a domestic microwave oven. The prepared nanocomposites have been characterized by Fourier transform infrared (FTIR) spectroscopy, X-ray diffraction (XRD) analysis, scanning electron microscopy (SEM) and UV- visible spectroscopy. The crystalline properties...

A structure elucidation strategy combining X-ray Absorption Spectroscopy (XAS) and Density Functional Theory (DFT) is demonstrated and reveals the existence of the [Tc=O](2+) moiety.

Nanocrystals of ZnO were prepared by microwave irradiation using Zn (II) acetate and triethanol amin (TEA) as the starting materials and water as solvent. The nanocrystals of ZnO with hexagonal (Wurtzite) structure were characterized by X-ray powder diffraction (XRD), transmission electron microscopy (TEM), scanning electron microscopy (SEM), UV-Vis absorption and FTIR Spectroscopy techniques.

In this research Calcium fluoride nanoparticles and its different amount of cerium ion dopant (5%and 10%) were prepared. The mentioned nanoparticle were studied by fourier transform infrared spectroscopy (FTIR) , X-ray diffraction (XRD), absorption and photoluminescence spectra (PL) and Scanning electron microscopy (SEM). The XRD patterns indicate a typical cubic fluorite structure and no other...

Tin oxide (SnO2)nanoparticles were synthesized by co-precipitation method and the synthesized nanoparticles were annealed at different temperatures for characterization. The powders were investigated with X-ray diffraction, scanning electron microscopy and optical spectroscopy. The structural characterization was carried out by X-ray diffraction which confirms the crystalline nature ...

Hemoglobin (Hb) is the heme-containing O2 transport protein essential for life in all vertebrates. The resting high-spin (S = 2) ferrous form, deoxy-Hb, combines with triplet O2, forming diamagnetic (S = 0) oxy-Hb. Understanding this electronic structure is the key first step in understanding transition metal-O2 interaction. However, despite intense spectroscopic and theoretical studies, the el...