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1.
The Makishima and Mackenzie model has been used to determine the mechanical properties of the PbO-WO3-Na2O-MgO-B2O3 glass system. The number of bonds per unit volume of the glasses (nb) increases from 9.40 × 1022 to 10.09 × 1022 cm−3 as the PbO content increases from 30 to 50 mol%. The Poisson’s ratio (σ) for the examined glasses falls between 0.174 and 0.210. The value of the fractal bond connectivity (d) for the present glasses ranges from 3.08 to 3.59. Gamma photon and fast neutron shielding parameters were evaluated via Phy-X/PSD, while that of electrons were calculated via the ESTAR platform. Analysis of the parameters showed that both photon and electron attenuation ability improve with the PbO content. The fast neutron removal cross section of the glasses varies from 0.094–0.102 cm−1 as PbO molar content reduced from 50–30 mol%. Further analysis of shielding parameters of the investigated glass system showed that they possess good potential to function in radiation protection applications.  相似文献   

2.
In this research, a high-boron-content composite material with both neutron and γ rays shielding properties was developed by an optimized design and manufacture. It consists of 304 stainless steel as the matrix and spherical boron carbide (B4C) particles as the functional particles. The content of B4C is 24.68 wt%, and the particles’ radius is 1.53 mm. The density of the newly designed material is 5.17 g·cm−3, about 68.02% of that of traditional borated stainless steel containing 1.7 wt% boron, while its neutrons shielding performance is much better. Firstly, focusing on shielding properties and material density, the content and the size of B4C were optimized by the Genetic Algorithm (GA) program combined with the MCNP program. Then, some samples of the material were manufactured by the infiltration casting technique according to the optimized results. The actual density of the samples was 5.21 g cm−3. In addition, the neutron and γ rays shielding performance of the samples and borated stainless steel containing 1.7 wt% boron was tested by using an 241Am–Be neutron source and 60Co and 137Cs γ rays sources, respectively, and the results were compared. It can be concluded that the new designed material could be used as a material for nuclear power plants or spent-fuel storage and transportation containers with high requirements for mobility.  相似文献   

3.
For both the B2O3-Bi2O3-CaO and B2O3-Bi2O3-SrO glass systems, γ-ray and neutron attenuation qualities were evaluated. Utilizing the Phy-X/PSD program, within the 0.015–15 MeV energy range, linear attenuation coefficients (µ) and mass attenuation coefficients (μ/ρ) were calculated, and the attained μ/ρ quantities match well with respective simulation results computed by MCNPX, Geant4, and Penelope codes. Instead of B2O3/CaO or B2O3/SrO, the Bi2O3 addition causes improved γ-ray shielding competence, i.e., rise in effective atomic number (Zeff) and a fall in half-value layer (HVL), tenth-value layer (TVL), and mean free path (MFP). Exposure buildup factors (EBFs) and energy absorption buildup factors (EABFs) were derived using a geometric progression (G–P) fitting approach at 1–40 mfp penetration depths (PDs), within the 0.015–15 MeV range. Computed radiation protection efficiency (RPE) values confirm their excellent capacity for lower energy photons shielding. Comparably greater density (7.59 g/cm3), larger μ, μ/ρ, Zeff, equivalent atomic number (Zeq), and RPE, with the lowest HVL, TVL, MFP, EBFs, and EABFs derived for 30B2O3-60Bi2O3-10SrO (mol%) glass suggest it as an excellent γ-ray attenuator. Additionally, 30B2O3-60Bi2O3-10SrO (mol%) glass holds a commensurably bigger macroscopic removal cross-section for fast neutrons (ΣR) (=0.1199 cm−1), obtained by applying Phy-X/PSD for fast neutrons shielding, owing to the presence of larger wt% of ‘Bi’ (80.6813 wt%) and moderate ‘B’ (2.0869 wt%) elements in it. 70B2O3-5Bi2O3-25CaO (mol%) sample (B: 17.5887 wt%, Bi: 24.2855 wt%, Ca: 11.6436 wt%, and O: 46.4821 wt%) shows high potentiality for thermal or slow neutrons and intermediate energy neutrons capture or absorption due to comprised high wt% of ‘B’ element in it.  相似文献   

4.
Benzene alkylation with propylene was studied in the gas phase using a catalytic membrane reactor and a fixed-bed reactor in the temperature range of 200–300 °C and with a weight hourly space velocity (WHSV) of 51 h−1. β-zeolite was prepared by hydrothermal synthesis using silica, aluminum metal and TEAOH as precursors. The membrane’s XRD patterns showed good crystallinity for the β-zeolite film, while scanning electron microscopy SEM results indicated that its random polycrystalline film was approximately 1 μm thick. The powders’ specific area was determined to be 400 m2·g−1 by N2 adsorption/desorption, and the TPD results indicated an overall acidity of 3.4 mmol NH3·g−1. Relative to the powdered catalyst, the catalytic membrane showed good activity and product selectivity for cumene.  相似文献   

5.
The pseudomorphic transformation of spherical silica gel (LiChrospher® Si 60) into MCM-41 was achieved by treatment at 383 K for 24 h with an aqueous solution of cetyltrimethylammonium hydroxide (CTAOH) instead of hexadecyltrimethylammonium bromide (CTABr) and NaOH. The degree of transformation was varied via the ratio of CTAOH solution to initial silica gel rather than synthesis duration. The transformed samples were characterized by N2 sorption at 77 K, mercury intrusion porosimetry, X-ray diffraction (XRD) and scanning electron microscopy (SEM). Thus, MCM-41 spheres with diameters of ca. 12 μm, surface areas >1000 m2 g−1, pore volumes >1 cm3 g−1 and a sharp pore width distribution, adjustable between 3.2 and 4.5 nm, were obtained. A thorough pulsed field gradient nuclear magnetic resonance (PFG NMR) study shows that the diffusivity of n-heptane confined in the pores of the solids passes through a minimum with progressing transformation. The final product of pseudomorphic transformation to MCM-41 does not exhibit improved transport properties compared to the initial silica gel. Moreover, the PFG NMR results support that the transformation occurs via formation and subsequent growth of domains of <1 μm containing MCM-41 homogeneously distributed over the volume of the silica spheres.  相似文献   

6.
In this work, some marble types were collected from Egypt, and their shielding characteristics were estimated. Their rigidity, in addition to their elegant shape, led us to consider their use as a protective shield, in addition to making the workplace more beautiful. The mass attenuation coefficient (μ/ρ) was calculated for three types of marble (Breshia, Galala, and Trista) experimentally, using a narrow gamma ray source and high pure germanium (HPGe). The results obtained were compared with the XCOM program and indicated a very good agreement between the two methods. The linear attenuation coefficient (μ) was evaluated to calculate the half and tenth value layers. The maximum μ value of 1.055, 1.041, and 1.024 cm−1 was obtained for Breshia, Galala, and Trista, respectively, at 0.06 MeV. The mean free path for studying the materials was compared with other shielding materials and showed good results at different energy scales. The energy absorption (EABF) and exposure buildup factors (EBF) were determined at different mean free paths. The fast neutron removal cross section ΣR was calculated and expresses the ability of the marbles to slow down fast neutrons through multiple scattering. This is the ability of the marbles to shield fast neutrons.  相似文献   

7.
Developing inexpensive and rapid fabrication methods for high efficiency thermoelectric alloys is a crucial challenge for the thermoelectric industry, especially for energy conversion applications. Here, we fabricated large amounts of p-type Cu0.07Bi0.5Sb1.5Te3 alloys, using water atomization to control its microstructure and improve thermoelectric performance by optimizing its initial powder size. All the water atomized powders were sieved with different aperture sizes, of 32–75 μm, 75–125 μm, 125–200 μm, and <200 μm, and subsequently consolidated using hot pressing at 490 °C. The grain sizes were found to increase with increasing powder particle size, which also increased carrier mobility due to improved carrier transport. The maximum electrical conductivity of 1457.33 Ω−1 cm−1 was obtained for the 125–200 μm samples due to their large grain sizes and subsequent high mobility. The Seebeck coefficient slightly increased with decreasing particle size due to scattering of carriers at fine grain boundaries. The higher power factor values of 4.20, 4.22 × 10−3 W/mk2 were, respectively, obtained for large powder specimens, such as 125–200 μm and 75–125 μm, due to their higher electrical conductivity. In addition, thermal conductivity increased with increasing particle size due to the improvement in carriers and phonons transport. The 75–125 μm powder specimen exhibited a relatively high thermoelectric figure of merit, ZT of 1.257 due to this higher electric conductivity.  相似文献   

8.
Novel glass samples with the composition 75TeO2–5Ta2O5–15Nb2O5–5x (where x = ZnO, MgO, TiO2, or Na2O) in mole percent were prepared. The physical, optical, and gamma radiation shielding properties of the glass samples were studied over a wide energy spectrum ranging between 0.015 and 20 MeV. The glasses’ UV–vis spectra were utilized to evaluate the optical energy gap and refractive index. Glass samples had a refractive index ranging from 2.2005 to 2.0967. The results showed that the sample doped with zinc oxide (ZnO) recorded the highest density (ρglass), molar polarizability (αm), molar refraction (Rm), refractive index (n), and third-order nonlinear optical susceptibility (χ3) and the lowest optical energy gap (Eopt) among the samples under investigation. When comparing the current glass system with various standard glass shielding materials, the prepared glass system showed superior shielding performance at energies ranging between 40 and 85 keV. These findings indicate that the prepared glass systems can be used in diagnostic X-rays, especially in dental applications.  相似文献   

9.
This study carried out a comparison of the optical and gamma ray shielding features of TeO2 with and without ZnO modifier concentration. Incorporating ZnO into the TeO2 network reduces the indirect band gap from 3.515–3.481 eV. When ZnO is added, refractive indices, dielectric constants, and optical dielectric constants rise from 2.271–2.278, 5.156–5.191, and 4.156–4.191 accordingly. The transmission coefficient and reflection loss are in direct opposition to each other. With increasing ZnO concentration in the selected glasses, the values of molar refractivity and molar polarizability decrease from 18.767–15.018 cm3/mol and from 7.444 × 10−24–5.957 × 10−24 cm3, respectively, while the electronic polarizability rises from 8.244 × 1024–8.273 × 1024, correspondingly. As expected by the metallization values, the glass systems are non-metallic. The linear attenuation coefficients (LAC) of the studied glass samples ensue through enhancing the photon energy range 0.0395–0.3443 MeV. There is a very slow decrease in the LAC from an energy of 0.1218–0.3443 MeV, yet there is a sharp decrease from an energy of 0.0401–0.0459 MeV. According to the obtained values of numerous shielding parameters such as LAC, MAC, HVL, MFP, and Zeff sample, Zn30 has shown the best radiation shielding ability comprising other studied samples.  相似文献   

10.
High-entropy alloys are a new generation of materials that have attracted the interest of numerous scientists because of their unusual properties. It seems interesting to use these alloys in biomedical applications. However, for this purpose, the basic condition of corrosion resistance must be fulfilled. In this article, selected corrosion properties of self-composed high-entropy alloys are investigated and compared with conventional biomedical alloys, that is titanium alloys and stainless steels. Corrosive parameters were determined using the potentiodynamic method. X-ray diffraction studies were performed to characterize the crystal structures. Microstructures of the prepared materials were examined using a scanning electron microscope, and surface hardness was measured by the Vickers method. The results show that investigated high-entropy alloys are characterized by simple structures. Three out of four tested high-entropy alloys had better corrosion properties than conventional implant alloys used in medicine. The Al0.7CoCrFeNi alloy was characterized by a corrosion potential of −224 mV and a corrosion current density of 0.9 μA/cm2; CoCrFeNiCu by −210 mV and 1.1 μA/cm2; TiAlFeCoNi by −435 mV and 4.6 μA/cm2; and Mn0.5TiCuAlCr by −253 mV and 1.3 μA/cm2, respectively. Therefore, the proposed high-entropy alloys can be considered as potential materials for biomedical applications, but this requires more studies to confirm their biocompatibility.  相似文献   

11.
In this paper, the study of defects in InAs/GaSb type-II superlattices using high-resolution an x-ray diffraction method as well as scanning (SEM) and transmission (TEM) electron microscopy is presented. The investigated superlattices had 200 (#SL200), 300 (#SL300), and 400 (#SL400) periods and were grown using molecular beam epitaxy. The growth conditions differed only in growth temperature, which was 370 °C for #SL400 and #SL200, and 390 °C for #SL300. A wings-like diffuse scattering was observed in reciprocal space maps of symmetrical (004) GaSb reflection. The micrometer-sized defect conglomerates comprised of stacking faults, and linear dislocations were revealed by the analysis of diffuse scattering intensity in combination with SEM and TEM imaging. The following defect-related parameters were obtained: (1) integrated diffuse scattering intensity of 0.1480 for #SL400, 0.1208 for #SL300, and 0.0882 for #SL200; (2) defect size: (2.5–3) μm × (2.5–3) μm –#SL400 and #SL200, (3.2–3.4) μm × (3.7–3.9) μm –#SL300; (3) defect diameter: ~1.84 μm –#SL400, ~2.45 μm –#SL300 and ~2.01 μm –#SL200; (4) defect density: 1.42 × 106 cm−2 –#SL400, 1.01 × 106 cm−2 –#SL300, 0.51 × 106 cm−2 –#SL200; (5) diameter of stacking faults: 0.14 μm and 0.13 μm for #SL400 and #SL200, 0.30 μm for #SL300.  相似文献   

12.
Carbon xerogels were synthesized using a soft-template route with resorcinol as the carbon source and sodium carbonate as the catalyst. The influence of the resorcinol to catalyst ratio in the range of 500–20,000 on pore structure, graphitic domains, and electronic conductivity of as-prepared carbon xerogels, as well as their performance in an aluminium ion battery (AIB), was investigated. After carbonization steps of the polymers up to 800 °C, all carbon samples exhibited similar specific volumes of micropores (0.7–0.8 cm³ g−1), while samples obtained from mixtures with R/C ratios lower than 2000 led to carbon xerogels with significantly higher mesopore diameters up to 6 nm. The best results, in terms of specific surface (1000 m² g−1), average pore size (6 nm) and reversible capacity in AIB cell (28 mAh g−1 @ 0.1 A g−1), were obtained with a carbon xerogel sample synthetized at a resorcinol to catalyst ratio of R/C = 500 (CXG500). Though cyclic voltammograms of carbon xerogel samples did not exhibit any sharp peaks in the applied potential window, the presence of both oxidation and a quite wide reduction peak in CXG500–2000 cyclic voltammograms indicated pseudocapacitance behaviour induced by diffusion-controlled intercalation/de-intercalation of AlCl4 ions into/from the carbon xerogel matrix. This was confirmed by shifting of the (002) peak towards lower 2θ angle values in the XRD pattern of the CXG500 electrode after the charging step in AIB, whereas the contribution of pseudocapacitance, calculated from half-cell measurements, was limited to only 6% of overall capacitance.  相似文献   

13.
The thermoelectric cement-based materials can convert heat into electricity; this makes them promising candidates for impressed current cathodic protection of carbon steel. However, attempts to use the thermoelectric cement-based materials for energy conversion usually results in low conversion efficiency, because of the low electrical conductivity and Seebeck coefficient. Herein, we deposited polyaniline on the surface of MnO2 and fabricated a cement-based thermoelectric device with added PANI/MnO2 composite for the protection of carbon steel in alkaline chloride solution. The nanorod structure (70~80 nm in diameter) and evenly dispersed conductive PANI provide the PANI/MnO2 composite with good electrical conductivity (1.9 ± 0.03 S/cm) and Seebeck coefficient (−7.71 × 103 ± 50 μV/K) and, thereby, increase the Seebeck coefficient of cement-based materials to −2.02 × 103 ± 40 μV/K and the electrical conductivity of cement-based materials to 0.015 ± 0.0003 S/cm. Based on this, the corrosion of the carbon steel was delayed after cathodic protection, which was demonstrated by the electrochemical experiment results, such as the increased resistance of the carbon steel surface from 5.16 × 102 Ω·cm2 to 5.14 × 104 Ω·cm2, increased charge transfer resistance from 11.4 kΩ·cm2 to 1.98 × 106 kΩ·cm2, and the decreased corrosion current density from 1.67 μA/cm2 to 0.32 μA/cm2, underlining the role of anti-corrosion of the PANI/MnO2 composite in the cathodic protection system.  相似文献   

14.
Hierarchical porous carbons are known to enhance the electrochemical features of electrodes in electrochemical capacitors. However, the contribution of surface oxygen and the resulting functionalities and wettability, along with the role of electrical conductivity and degree of amorphous or crystalline nature in the micro-mesoporous carbons, are not yet clear. This article considers the effect of carbonisation temperature (500–900 °C) and the type of activation (CO2, KOH) on the properties mentioned above in case of carbon xerogels (CXs) to understand the resulting electrochemical performances. Depending on the carbonisation temperature, CX materials differ in micropore surface area (722–1078 m2 g−1) while retaining a mesopore surface area ~300 m2 g−1, oxygen content (3–15%, surface oxygen 0–7%), surface functionalities, electrical conductivity (7 × 10−6–8 S m−1), and degree of amorphous or crystalline nature. Based on the results, electrochemical performances depend primarily on electrical conductivity, followed by surface oxygen content and meso-micropore connectivity. The way of activation using a varied extent of CO2 exposure and KOH concentrations played differently in CX in terms of pore connectivity from meso- to micropores and their contributions and degree of oxidation, and resulted in different electrochemical behaviours. Such performances of activated CXs depend solely on micro-mesopore features.  相似文献   

15.
In this study, dense anticorrosion magnesium–aluminum layered double hydroxide (MgAl-LDH) films were prepared for the first time by introducing a cationic surfactant tetradecyltrimethyl ammonium bromide (TTAB) in the process of in situ hydrothermal synthesis of Mg-Al LDH films on an AZ31 magnesium alloy. Results of XRD, FTIR, and SEM confirmed that TTAB forms the MgAl-LDH-TTAB, although TTAB cannot enter into LDH layers, and MgAl-LDH-TTAB powders are much smaller and more homogenous than MgAl-CO32−-LDH powders. Results of SEM, EDS, mapping, and XPS confirmed that TTAB forms the MgAl-LDH-TTAB films and endows LDH films with denser structure, which provides films with better shielding efficiency. Results of potentiodynamic polarization curves (PDP) and electrochemical impedance spectroscopy (EIS) confirmed that MgAl-LDH-TTABx g films have better corrosion resistance than an MgAl-CO32−-LDH film. The corrosion current density (icorr) of the MgAl-LDH-TTAB0.35 g film in 3.5 wt.% NaCl solution was reduced to 1.09 × 10−8 A.cm−2 and the |Z|f = 0.05 Hz value was increased to 4.48 × 105 Ω·cm2. Moreover, the increasing concentration of TTAB in MgAl-LDH-TTABx g (x = 0.025, 0.05, 0.1, 0.2 and 0.35) provided denser outer layer LDH films and thereby increased the corrosion resistance of the AZ31 Mg alloy. Additionally, the |Z|f = 0.05 Hz values of the MgAl-LDH-TTAB0.35 g film still remained at 105 Ω·cm2 after being immersed in 3.5 wt.% NaCl solution for 168 h, implying the good long-term corrosion resistance of MgAl-LDH-TTABx g films. Therefore, introducing cationic surfactant in the process of in situ hydrothermal synthesis can be seen as a novel approach to creating efficient anticorrosion LDH films for Mg alloys.  相似文献   

16.
We successfully demonstrated a transition from a metallic InOx film into a nondegenerate semiconductor InOx:H film. A hydrogen-doped amorphous InOx:H (a-InOx:H) film, which was deposited by sputtering in Ar, O2, and H2 gases, could be converted into a polycrystalline InOx:H (poly-InOx:H) film by low-temperature (250 °C) solid-phase crystallization (SPC). Hall mobility increased from 49.9 cm2V−1s−1 for an a-InOx:H film to 77.2 cm2V−1s−1 for a poly-InOx:H film. Furthermore, the carrier density of a poly-InOx:H film could be reduced by SPC in air to as low as 2.4 × 1017 cm−3, which was below the metal–insulator transition (MIT) threshold. The thin film transistor (TFT) with a metallic poly-InOx channel did not show any switching properties. In contrast, that with a 50 nm thick nondegenerate poly-InOx:H channel could be fully depleted by a gate electric field. For the InOx:H TFTs with a channel carrier density close to the MIT point, maximum and average field effect mobility (μFE) values of 125.7 and 84.7 cm2V−1s−1 were obtained, respectively. We believe that a nondegenerate poly-InOx:H film has great potential for boosting the μFE of oxide TFTs.  相似文献   

17.
The mechanical and radiation shielding features were reported for a quaternary Na2O-CaO-SiO2-TiO2 glass system used in radiation protection. The fundamentals of the Makishima–Mazinize model were applied to evaluate the elastic moduli of the glass samples. The elastic moduli, dissociation energy, and packing density increased as TiO2 increased. The glasses’ dissociation energy increased from 62.82 to 65.33 kJ/cm3, while the packing factor slightly increased between 12.97 and 13.00 as the TiO2 content increased. The MCNP-5 code was used to evaluate the gamma-ray shielding properties. The best linear attenuation coefficient was achieved for glass samples with a TiO2 content of 9 mol%: the coefficient decreased from 5.20 to 0.14 cm−1 as the photon energy increased from 0.015 to 15 MeV.  相似文献   

18.
The direct influence of La3+ ions on the gamma-ray shielding properties of cobalt-doped heavy metal borate glasses with the chemical formula 0.3CoO-(80-x)B2O3-19.7PbO-xLa2O3: x = 0, 0.5, 1, 1.5, and 2 mol% was examined herein. Several significant radiation shielding parameters were evaluated. The glass density was increased from 3.11 to 3.36 g/cm3 with increasing La3+ ion content from 0 to 2 mol%. The S5 glass sample, which contained the highest concentration of La3+ ions (2 mol%), had the maximum linear (μ) and mass (μm) attenuation coefficients for all photon energies entering, while the S1 glass sample free of La3+ ions possessed the minimum values of μ and μm. Both the half value layer (T1/2) and tenth value layer (TVL) of all investigated glasses showed a similar trend of (T1/2, TVL)S1 > (T1/2, TVL)S2 > (T1/2, TVL)S3 > (T1/2, TVL)S4 > (T1/2, TVL)S5. Our results revealed that the S5 sample had the highest effective atomic number (Zeff) values over the whole range of gamma-ray energy. S5 had the lowest exposure (EBF) and energy absorption (EABF) build-up factor values across the whole photon energy and penetration depth range. Our findings give a strong indication of the S5 sample’s superior gamma-ray shielding characteristics due to the highest contribution of lanthanum oxide.  相似文献   

19.
SnOx films were deposited on a hydrogen-terminated diamond by thermal oxidation of Sn. The X-ray photoelectron spectroscopy result implies partial oxidation of Sn film on the diamond surface. The leakage current and capacitance–voltage properties of Al/SnOx/H-diamond metal-oxide-semiconductor diodes were investigated. The maximum leakage current density value at −8.0 V is 1.6 × 10−4 A/cm2, and the maximum capacitance value is measured to be 0.207 μF/cm2. According to the C–V results, trapped charge density and fixed charge density are determined to be 2.39 × 1012 and 4.5 × 1011 cm−2, respectively. Finally, an enhancement-mode H-diamond field effect transistor was obtained with a VTH of −0.5 V. Its IDMAX is −21.9 mA/mm when VGS is −5, VDS is −10 V. The effective mobility and transconductance are 92.5 cm2V−1 s−1 and 5.6 mS/mm, respectively. We suspect that the normally-off characteristic is caused by unoxidized Sn, whose outermost electron could deplete the hole in the channel.  相似文献   

20.
For the catalytic cycle of soluble methane monooxygenase (sMMO), it has been proposed that cleavage of the O–O bond in the (μ-peroxo)diiron(III) intermediate P gives rise to the diiron(IV) intermediate Q with an Fe2(μ–O)2 diamond core, which oxidizes methane to methanol. As a model for this conversion, (μ–oxo) diiron(III) complex 1 ([FeIII2(μ–O)(μ–O2H3)(L)2]3+, L = tris(3,5-dimethyl-4-methoxypyridyl-2-methyl)amine) has been treated consecutively with one eq of H2O2 and one eq of HClO4 to form 3 ([FeIV2(μ–O)2(L)2]4+). In the course of this reaction a new species, 2, can be observed before the protonation step; 2 gives rise to a cationic peak cluster by ESI-MS at m/z 1,399, corresponding to the {[Fe2O3L2H](OTf)2}+ ion in which 1 oxygen atom derives from 1 and the other two originate from H2O2. Mössbauer studies of 2 reveal the presence of two distinct, exchange coupled iron(IV) centers, and EXAFS fits indicate a short Fe–O bond at 1.66 Å and an Fe–Fe distance of 3.32 Å. Taken together, the spectroscopic data point to an HO-FeIV-O-FeIV = O core for 2. Protonation of 2 results in the loss of H2O and the formation of 3. Isotope labeling experiments show that the [FeIV2(μ–O)2] core of 3 can incorporate both oxygen atoms from H2O2. The reactions described here serve as the only biomimetic precedent for the conversion of intermediates P to Q in the sMMO reaction cycle and shed light on how a peroxodiiron(III) unit can transform into an [FeIV2(μ–O)2] core.  相似文献   

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