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 共查询到17条相似文献,搜索用时 125 毫秒
1.
田晓峰  龙冲生  朱正和  高涛 《中国物理 B》2010,19(5):57102-057102
This paper performs atomic simulations of the nucleation and growth of Xe bubble in UO2 at 1600 K.The bubble growth was simulated up to the bubble containing 50 Xe atoms.The Xe atoms were added directly to the bubble one by one,followed by a relaxation of the system for several picoseconds.The simulations estimated the bubble pressure and radius at different Xe concentrations.The results indicate that the bubble pressure drops with the increasing Xe/U and bubble size at low Xe concentration,while the pressure will increase with the Xe/U ratio at high Xe concentration.The swelling of the system associated with the bubble growth was also obtained.Finally,the recovery of the damaged structure was investigated.  相似文献   

2.
张宝玲  汪俊  侯氢 《中国物理 B》2011,20(3):36105-036105
In this paper,the pressure state of the helium bubble in titanium is simulated by a molecular dynamics(MD) method.First,the possible helium/vacancy ratio is determined according to therelation between the bubble pressure and helium/vacancy ratio;then the dependences of the helium bubble pressure on the bubble radius at different temperatures are studied.It is shown that the product of the bubble pressure and the radius is approximately a constant,a result justifying the pressure-radius relation predicted by thermodynamics-based theory for gas bubble.Furthermore,a state equation of the helium bubble is established based on the MD calculations.Comparison between the results obtained by the state equation and corresponding experimental data shows that the state equation can describe reasonably the state of helium bubble and thus could be used for Monte Carlo simulations of the evolution of helium bubble in metals.  相似文献   

3.
Classical molecular dynamics simulations are used to investigate the fission gas Xe behavior in a U-Mo alloy fuel matrix. The embedded atom method potential proposed by Smirnova et al. is used to describe the U-Mo-Xe system. The results show that the initial configuration of interstitial Xe atoms in U-Mo alloys is very instable and has a strong tendency to get together and to form a Xe bubble by ejecting the adjacent U atoms and Mo atoms from their former normal lattice sites. The pressure in Xe bubbles is initially quite high and then drops with increasing Xe concentration obviously. The matrix swelling of U-Mo alloys associated with the Xe bubble growth follows approximately a linear relationship with the ratio of Xe to U at low Xe concentration while the rate of swelling increases rapidly at high Xe concentration. The simulation results are in good agreement with the experimental data. The recovery of the damaged structure in the U-Mo alloys matrix is also investigated. It is shown that a damaged structure cannot be recovered completely after a system is relaxed for a long time while still having lots of defects.  相似文献   

4.
We present a theoretical calculation finding that a spectrum from ion beam analysis will change at different stopping cross sections. This is more visible at a deeper place in the sample. Helium-contained Ti films annealed at different temperatures are prepared to gain different stopping cross sections whereby the stopping cross section will change with the helium phase states and the pressure of helium bubbles. Then ion beam analysis is used to measure the concentration of helium. It is found that the concentration curve rises greatly after the sample is annealed at 673K which reflects the increasing size of the helium bubble. The results axe consistent with that of positron annihilation radiation spectra which are performed by using a changeable energy positron beam.  相似文献   

5.
Both hollow-cathode and Penning-type discharges were adopted to excite helium atoms to a metastable state. Experimental data indicate that Penning discharge is more suitable for generating high fractions of metastables in a low-density helium beam for laser-induced fluorescence technique in measuring electric fields at the edge of a plasma. The metastable density increases with increasing helium gas pressure in the range of 1.33×10^{-2}-66.7Pa. The highest metastable density of 3.8×10^{16}m^{-3} is observed at a static gas pressure of 66.7Pa. An approximately linear relationship between the density of metastable helium atoms and the plasma discharge current is observed. Magnetic field plays a very important role in producing a high density of metastable atoms in Penning discharge.  相似文献   

6.
The initial growth stage of GaSb on GaAs(001) by low pressure metal–organic chemical vapor deposition(MOCVD)is investigated. The dependence of the nucleation on growth temperature, growth pressure, and vapor V/III ratio is studied by means of atomic force microscopy. The nucleation characteristics include the island density, size, and size uniformity distribution. The nucleation mechanism is discussed by the effects of growth temperature, growth pressure, and vapor V/III ratio on the density, size, and size uniformity of GaSb islands. With the growth temperature increasing from 500℃ to610℃ and the growth pressure increasing from 50 mbar to 1000 mbar(1 mbar = 105Pa), the island density first increases and then decreases; with the V/III ratio increasing from 0.5 to 3, the trend is contrary.  相似文献   

7.
Helium-charged nanocrystalline titanium films have been deposited by HeAr magnetron co-sputtering. The effects of substrate temperature on the helium content and microstructure of the nanocrystalline titanium films have been studied. The results indicate that helium atoms with a high concentration are evenly incorporated in the deposited titanium films. When the substrate temperature increases from 60℃ to 350℃ while the other deposition'parameters are fixed, the helium content decreases gradually from 38.6 at.% to 9.2at.%, which proves that nanocrystalline Ti films have a great helium storage capacity. The 20 angle of the Bragg peak of (002) crystal planes of the He-charged Ti film shifts to a lower angle and that of (100) crystal plane is unchanged as compared with that of the pure Ti film, which indicates that the lattice parameter c increases and a keeps at the primitive value. The grain refining and helium damage result in the diffraction peak broadening.  相似文献   

8.
A small electrical explosion of wire (EEW) setup for nanopowder production is constructed. It consists of a low inductance capacitor bank of 2 μF-4 μF typically charged to 8 kV-30 kV, a triggered gas switch, and a production chamber housing the exploding wire load and ambient gas. With the EEW device, nanosize powders of titanium oxides, titanium nitrides, copper oxides, and zinc oxides are successfully synthesized. The average particle size of synthesized powders under different experimental conditions is in a range of 20nm-80nm. The pressure of ambient gas or wire vapor can strongly affect the average particle size. The lower the pressure, the smaller the particle size is. For wire material with relatively high resistivity, such as titanium, whose deposited energy Wd is often less than sublimation energy W s due to the flashover breakdown along the wire prematurely ending the Joule heating process, the synthesized particle size of titanium oxides or titanium nitrides increases with overheat coefficient k (k = W d /Ws ) increasing.  相似文献   

9.
The nickel-base alloy is one of the leading candidate materials for generation IV nuclear reactor pressure vessel.To evaluate its stability of helium damage and retention,helium ions with different energy of 80 keV and 180 keV were introduced by ion implantation to a certain dose(peak displacement damage 1-10 dpa).Then thermal desorption spectroscopy(TDS)of helium atoms was performed to discuss the helium desorption characteristic and trapping sites.The desorption peaks shift to a lower temperature with increasing dpa for both 80 keV and 180 keV irradiation,reflecting the reduced diffusion activation energy and faster diffusion within the alloy.The main release peak temperature of 180 keV helium injection is relatively higher than that of 80 keV at the same influence,which is because the irradiation damage of 180 keV,helium formation and entrapment occur deeper.The broadening of the spectra corresponds to different helium trapping sites(He-vacancies,grain boundary)and desorption mechanisms(different Hen Vm size).The helium retention amount of 80 keV is lower than that of 180 keV,and a saturation limit associated with the irradiation of 80 keV has been reached.The relatively low helium retention proves the better resistance to helium bubbles formation and helium brittleness.  相似文献   

10.
The potential of controlling shockwave–boundary layer interactions(SWBLIs) in air by plasma aerodynamic actuation is demonstrated. Experiments are conducted in a Mach 3 in-draft air tunnel. The separation-inducing shock is generated with a diamond-shaped shockwave generator located on the wall opposite to the surface electrodes, and the flow properties are studied with schlieren imaging and static wall pressure probes. The measurements show that the separation phenomenon is weakened with the plasma aerodynamic actuation, which is observed to have significant control authority over the interaction. The main effect is the displacement of the reflected shock. Perturbations of incident and reflected oblique shocks interacting with the separation bubble in a rectangular cross section supersonic test section are produced by the plasma actuation. This interaction results in a reduction of the separation bubble size, as detected by phase-lock schlieren images.The measured static wall pressure also shows that the separation-inducing shock is restrained. Our results suggest that the boundary layer separation control through heating is the primary control mechanism.  相似文献   

11.
陈敏  汪俊  侯氢 《物理学报》2009,58(2):1149-1153
采用分子动力学(molecular dynamics,MD)方法研究了不同压力下氦-空位复合物的大小、氦含量对材料肿胀、稳定性的影响. 分析了影响材料体积改变及稳定性因素:随着氦含量的增加,体系内聚能减小,系统体积膨胀,稳定性降低;当氦-空位复合物较小时,随着氦-空位复合物的增大,体系内聚能增加,系统体胀减小,体系趋于稳定. 当氦泡中氦原子达到一定数量时氦泡不再继续长大. 关键词: 体胀 氦-空位复合物 钛 分子动力学  相似文献   

12.
主要利用分子动力学方法模拟计算了含氦泡的铝的弹性性质,首先,应用第一性原理的方法计算了Al-He的相互作用势.其次,从两个不同的方面研究了氦泡对铝弹性常数的影响,一是不同的氦泡尺寸(直径分别是16, 20, 25, 30和3.5nm),二是不同的氦泡压力(即固定氦泡大小,氦泡内氦原子的个数与空位的比分别大约是5%,15%,45% 和85%).结果表明弹性常数随着氦泡半径的增大而减小,对于固定大小的氦泡,随着氦泡内的压力变化弹性常数基本保持恒定.最后通过建立弹性复合体模型,得到的解析解定性上解释了氦泡的大小以及内压对铝的弹性常数的影响,与分子动力学模拟结果吻合. 关键词: 辐照损伤 氦泡 分子动力学 弹性常数  相似文献   

13.
14.
为了深入认识α-Fe中氦泡冲出位错环的微观机制,有必要研究α-Fe中氦泡冲出位错环时的极限压强特性.本文建立金属-氦泡的立方体型代表性体积单元模型,针对8种不同初始半径的球形氦泡,以初始氦空位比为变量,开展分子动力学模拟,得到了各模型中位错环开始形成时的氦泡极限压强和临界氦空位比.研究结果表明:对于无量纲半径介于2—10的氦泡,冲出位错环时的氦泡极限压强和临界氦空位比均随着氦泡初始半径的增大而非线性减小;基体中氦泡冲出位错环时的临界氦空位比具有明显的尺寸效应;初始时刻(0 ps),在经过立方体型模型中心的横截面上,氦泡周围Fe原子阵列的剪应力集中和最大剪应力出现在对角线与氦泡边界交点(即45°)处,并且关于横截面上平行于边的两条对折线对称分布,剪应力集中区的范围和最大剪应力均随着初始氦空位比的增大而增大;位错环冲出方向对应最大剪应力方向.本文的研究加深了对金属中氦泡物理特性的认识,为后续分析氦泡对材料宏观物理和力学性质的影响奠定了有益的基础.  相似文献   

15.
钨(W)是潜在的聚变堆面向等离子体材料.聚变反应中产生的氦(He)不溶于金属W,并在其中易聚集形成He泡,使W基体发生脆化,从而导致W基体的性能发生退化.在前人工作的基础上,本文采用分子动力学研究了He泡在单晶bcc-W中以及bcc-W中∑3[211](110)和∑9[110](411)晶界处He泡形核长大初期的演化过程.结果发现,晶界处He泡的长大机制和单晶W中有所不同.单晶W中He泡通过挤出位错环促进长大.而He泡在∑3[211](110)晶界处的长大机制为:首先挤出并发射少量自间隙W原子,而后挤出1/2⟨111⟩位错线,随后,该位错线会沿晶界面上[111]方向迁移出去;在∑9[110](411)晶界处,He泡在我们的模拟时间尺度范围内没有观察到W自间隙子的发射和位错的挤出.  相似文献   

16.
采用分子动力学方法研究了钛金属表面下不同深度处氦泡的行为,分析了氦泡融合与释放的竞争,对比了不同深度处氦泡的释放对金属的影响。结果表明:在接近金属表面处,氦泡很难通过融合无限长大,当达到临界尺寸后,氦泡将会释放而不再与邻近的氦泡发生融合;植入深度对氦泡的融合有一定的影响,深度越大,越有利于形成具有较高氦密度的大氦泡;较深处氦泡的释放会在金属表面形成较大的突起和表面针孔。实验中观察到的不同尺寸的表面孔,其部分原因来自于金属表面下不同深度处氦泡的释放。  相似文献   

17.
采用分子动力学方法研究了钛金属表面下不同深度处氦泡的行为,分析了氦泡融合与释放的竞争,对比了不同深度处氦泡的释放对金属的影响.结果表明:在接近金属表面处,氦泡很难通过融合无限长大,当达到临界尺寸后,氦泡将会释放而不再与邻近的氦泡发生融合;植入深度对氦泡的融合有一定的影响,深度越大,越有利于形成具有较高氦密度的大氦泡;较深处氦泡的释放会在金属表面形成较大的突起和表面针孔.实验中观察到的不同尺寸的表面孔,其部分原因来自于金属表面下不同深度处氦泡的释放.  相似文献   

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