نتایج جستجو برای: energy density

تعداد نتایج: 1015741  

The stored deformation energy in the dislocation structures in a polycrystalline metal can provide a sufficient  driving force to move grain boundaries during annealing. In this paper, a thermodynamically-consistent three-dimensional, finite-strain and dislocation density-based crystal viscoplasticity constitutive theory has been developed to describe the distribution of stored energy and dislo...

The morpholinium cation based ionic liquids are designed to evaluate the thermophysical, chemical reactivity, and biological activity. To estimate and design the bioactive ILs, propionate and trihalopropanoate were considered under theoretical study by Density Functional Theory (DFT). To make effect of halogens atom on anion, propionate, trifluro propionate, trichloro propionate, and tribromo p...

Increasing the molecular accumulation and density of high-energy substances have a determinative role in improving the performance and intensity of energy release. Therefore, it is possible to increase the density of high-energy materials if the high-energy molecules can be arranged around a metal core as coordinated molecules. The aim of this project was to synthesize energetic complexes of cy...

Introduction: Globally, the need for radiotherapy as a part of cancer management increases every year. Thus, the shielding for megavoltage radiotherapy rooms is of great importance. Materials and Methods: In the present study, 14 types of developed high-density concrete with densities ranging from 2.45 to 5.11 were simulated by using Monte Carlo method. The linear attenuation coefficient and t...

Monitoring the frequency changes of hard and non-degradable ostracod shells can provide valuable information about the past conditions of inland wetlands sediments as a biological index. In this regard, a sediment core with a length of 38 cm was harvested using a static sediment core sampler at the beginning of the delta of Gavkhooni international wetland (Shakh-Kenar station) in April 2019, an...

Journal: Journal of Nanoanalysis 2017

The density functional theory (DFT) calculations were used to get information concerning the interaction of curcumin with pristine and N-doped TiO2 anatase nanoparticles. Three adsorption geometries of curcumin over the TiO2 anatase nanoparticles were studied in order to fully exploit the sensing properties of TiO2 nanoparticles. Curcumin molecule adsorbs on the fivefold coordinated titanium si...

غضنفری مجرد, مهدی, مستأجران گورتانی, اعظم, موسوی خرشتمی, سیده کبری,

Using mean-field and semi-classical approximation of Thomas-Fermi, within a statistical model, equation of state and critical properties of symmetric nuclear matter is studied.  In this model, two body and phenomenological interaction of Myers and Swiatecki is used in phase space. By performing  a functional variation of the total Helmholtz free energy of system with respect to the nucleonic di...

اعظم انبارکی, , زهرا امینی لاری , , زهره کارگر, ,

The knowledge of nuclear reaction rates is important for studying energy production and nucleosynthesis, especially in reactions including nuclei far from stability line, which are not accessible experimentally so far and thus it is necessary to be able to predict reaction cross sections in low excitation energies. Nuclear level density is one of the important key quantities in many nuclear phy...

In this research, the effects of B, O and B&O−doped on the SO2 gas adsorption on the surface of the (4, 4) armchair AlNNTs are investigated by using DFT method. From optimized structures the geometrical and electrical properties, adsorption energy, gap energy, global hardness, electrical potential, HOMO−LUMO orbitals, density of states (DOS) plots, electrostatic potential (ESP) plots and NMR pa...

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