نتایج جستجو برای: doped b12n12
تعداد نتایج: 48232 فیلتر نتایج به سال:
Backgrounds and Objectives: Phenol and phenolic compounds are widely used in industry and daily liFe, and are of high interest due to stability in the environment, dissolution ability in water and health problems. In this regard, phenol removal from water is of high importance. The purpose of this study was to investigate the efficiency of photodegradation process for removal of phenol from aqu...
background: new treatment modalities are developed with the aim of escalating tumor absorbed dose and simultaneously sparing the normal structures. the use of nanotechnology in cancer treatment offers some possibilities including destroying cancer tumors with minimal damage to healthy tissues. zinc oxide nanoparticles (zno nps) are wide band gap semiconductors and seem to have a good effect on ...
the doping reaction of truncated boron nitride and carbon nanotubes with aluminium atom wastheoretically investigated. the am1, pm3, and pm6 semiempirical methods have been used toevaluate the thermochemistry of doping reactions of single walled boron nitride nanotubes andcarbon nanotubes. the enthalpy changes, gibbs free energy changes, and entropy changes of studieddoping reactions were evalu...
ultrasonic-assisted method was applied for preparation of cu+2-doped zns nanoparticles (mole fractions of cu+2 ions are 0.000, 0.015, 0.030 and 0.060) in water as a template-free and green method at 30 min. the prepared nanoparticles were investigated by powder x-ray diffraction (xrd), scanning electron microscopy (sem), energy dispersive x-ray (edx) and uv–vis diffuse reflectance spectra (drs)...
the antimicrobial effect of metal nanoparticles such as zinc oxide and silver nanoparticles has been taken into great consideration separately during recent years. the useful application of these nanoparticles in the areas of medicine, biotechnology, and professional prevention of microbes motivated us. the aim of this study was to evaluate antibacterial activity properties of silver doped zinc...
محاسبات تئوری تابعیت چگالی با استفاده از روشهای b3lyp و m06 و مجموعه پایه های 6-31g* ، 6-311++g** و lanl2dz به منظور بررسی نحوه جذب برخی مولکولهای قطبی و غیرقطبی بر روی مجموعه ای از کمپلکس های b79x شامل x=b, al, ga, n, f ، برخی ایزومرهای b80 و نانوساختار b12n12 انجام گرفته است. برای به دست آوردن یک دید جامع و توام با جزئیات در ارتباط با خصوصیات برهمکنش ها، پارامترهای ساختاری و الکترونی سامانه ب...
The adsorption of hydrogen sulfide molecule on undoped and N-doped TiO2/Au nanocomposites was investigated by density functional theory (DFT) calculations. The results showed that the adsorption energies of H2S on the nanocomposites follow the order of 2N doped (Ti site)>N-doped (Ti site)>Undoped (Ti site). The structural properties including bond lengths, angles<span id="...
Background and purpose: Sonocatalytic process as an advanced oxidation process is considered for degradation of pollutants in aqueous solution. The aim of this study was to increase the removal of dye by doping of TiO2 with non-metal element such as nitrogen. Materials and methods: Un-doped and N-doped TiO2 nano-particles with different nitrogen contents were synthesized by a simple sol–gel me...
We have performed a density functional theory investigation on the structural and electronic properties of pristine and Nitrogen-doped TiO2 anatase nanoparticles as the adsorbents for removal and degradation of hydrazine molecules in the environment. We have presented the most stable adsorption configurations and examined the interaction of hydrazine molecule with these doped and undoped nanopa...
highly crystalline bi3+-doped cadmium oxide (cdo) sub-micron structures were synthesized by calcination the obtained precursor from a sol-gel reaction. the reaction was carried out with cadmium nitrate (cd(no3)2.4h2o), bismuth nitrate (bi(no3)3.5h2o) and ethylene glycol (c2h6o2) reactants without any additives at 80°c for 2h. resulting gel was calcined at 900 °c with increasing temperature rate...
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