نتایج جستجو برای: Total Electron Density

تعداد نتایج: 1429870  

پایان نامه :دانشگاه تربیت معلم - تهران - دانشکده علوم 1393

in this thesis, structural, electronical, and optical properties of inverse pervskite(ca3pbo) in cubic phase have been investigated.the calculation have been done based on density functional theory and according to generalized gradiant approximate (gga) as correlating potential. in order to calculate the configurations, implementing in the wien2k code have been used from 2013 version. first of ...

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه یاسوج - دانشکده علوم 1391

in this investigation the effect of external field on the electron density of nanostructures of cds, cdse, cdte, gaas and polymeric structure of three, four, five and six units of cds as a kind of nanosolar cells has been studied theoretically. as modeling this system in nanodimension, molecular structures has used. specific properties of molecular structures permit us to consider different sym...

پایان نامه :وزارت علوم، تحقیقات و فناوری - پژوهشگاه دانشهای بنیادی (مرکز تحقیقات فیزیک نظری و - پژوهشکده علوم نانو 1392

among the low–dimensional allotropes of carbon, nanotubes and graphene have attracted very much attention from nano–science and nanotechnology specialists. they have been proposed as building blocks in nanometer device engineering. however, these structures are not defect–free. in this thesis, we focused on defective carbon nanotubes and graphene, and studied the effect of couple of very common...

پایان نامه :دانشگاه آزاد اسلامی - دانشگاه آزاد اسلامی واحد تهران مرکزی - دانشکده علوم پایه 1390

abstract in this study, we synthesized a novel template polymer by using methacrylic acid (mma) as functional monomer, ethylene glycol dimethacrylate(egdma) as cross linker, 2,2-azobisisobutyronitrile (aibn) as initiator and olanzapine as targeted molecule in the presence of chloroform and acetonitrile as solvent. the products have been characterized and confirmed by (chn)elemental analysis,...

پایان نامه :دانشگاه آزاد اسلامی - دانشگاه آزاد اسلامی واحد تهران مرکزی - دانشکده علوم پایه 1390

پیل سوختی میکروبی(mfc) شکل جدیدی از انرژی تجدید پذیر است.دراین پیل ها مواد آلی به عنوان سوخت مصرف می شوند وباازتجزیه مواد آلی توسط باکتریها انرژی الکتریکی تولید می شود.فاضلاب وپساب نیز می توانند به عنوان سوخت درپیل مصرف شوند وضمن تولید انرژی الکتریکی پساب نیز تصفیه می شود. در این تحقیق روند تولید انرژی وتصفیه شدن پساب با بررسی جریان،مقاومت ، ولتاژ پیل وآنالیز cod,tds,ec الکترولیت بررسی می شود. ...

2007
C. S. Zerefos

This study aims at providing experimental evidence, to support the hypothesis according to which the movement of the moon’s shadow sweeping the ozone layer at supersonic speed, during a solar eclipse, creates gravity waves in the atmosphere. An experiment was conducted to study eclipse induced thermal fluctuations in the ozone layer (via measurements of total ozone column, ozone photolysis rate...

Journal: :Structure 2011
Weikai Li Fang Li

The application of molecular replacement (MR) in macromolecular crystallography can be limited by the "model bias" problem. Here we propose a strategy to reduce model bias when only part of a new structure is known: after the MR search, structure determination of the unknown part of the new structure can be facilitated by cross-crystal averaging of the known part of the new structure with the s...

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