计算相图和热力学值和实验结果的一致性比较好。
The calculated phase diagram and thermodynamic quantities agree well with the experiment values.
存在强相互作用的三元氧化物体系的等温截面和多温截面应以实验数据为基础，同时参考计算相图。
For this kind system, the isothermal section and vertical section should be founded through the experiment result and referencing the calculated phase diagram at the same time.
这些条件能够让我们计算出气体相的组分比，这样我就得到了计算相图的所有的条件,除了我需要把x轴改y而不是。
So I have everything I need, then, to calculate and draw a diagram that looks just like this x Except where my x-axis is the y's instead of the x's.
对吗？一个比较好的猜想就是，这里的蒸汽压非常接近那个大气压,我们利用纯水的相图计算得到的,关键是，非常接近。
And a good guess is that that vapor pressure here, it's pretty close to the pressure that you would guess by using this diagram with the pure water. But the key word is, it's pretty close.
是可以做的，近似地考虑，要强调的是，我们现在可以计算，相图里面的线了。
Doable, approximately. But the point is, we can actually now locate all those lines that we sort of arbitrarily drew on the phase diagrams.
由二元系估算二元系和多元系的几何模型是当今在热力学和相图计算中用得最为广泛的一种溶液模型。
Geometrical model is a kind of solution model that has been used extensively in predicting thermodynamic properties and calculating phase diagrams for ternary and multicomponent systems.
利用VASP软件包可计算形成能、相图、电压和材料的晶体结构参数及态密度等。
The formation energy, phase diagram, voltage, crystal structural parameter and density of state can be calculated using VASP software package.
文中列有计算框图及对数种相图的计算结果。
The flowchart and the calculating results of several phase diagrams are presented in this paper.
简述了计算机在相图计算中的应用，对当前世界上使用最为广泛的两款相图计算软件进行了比较。
The application of computers in calculating phase diagrams is reviewed. Two kinds of the most widely used software are introduced and then compared with each other.
运用计算机图像处理技术对金相图像进行二值化处理后，采用图像跟踪算法可使单个晶粒面积的精确求取变得十分容易。
After that the computer image processing technology is used to carry on binary processing for metallographic image, tracking arithmetic makes accurate calculation of individual grain area very easy.
本文基于所计算的部分含bbo晶体的硼酸盐体系，研究了相图计算CALPHAD技术在BBO晶体生长过程中的一些应用。
Based on some calculated borate systems involving BBO crystal, the applications of CALPHAD technique in the crystal growth of BBO is presented.
针对相图模式识别评估，给出了一种新方法来计算预报中间化合物的生成与否和中间化合物的种类以及数量。
At present CALPHAD technique is not capable of predicting even whether there exists intermediate compound and much more predicting nothing about its formula and the number of intermediate compounds.
非平衡定态相图的计算就是该领域的重要结果，并与大量的金刚石气相生长实验相符。
Calculations for phase diagrams of stationary nonequilibrium states are important results in such a branch field. The calculated phase diagrams agree with a number of diamond growth experiments.
为对简单水盐体系的相图进行预测，提出了新的计算简单三元水盐体系相平衡的方法，并给出了该方法的程序和框图。
To forecast the phase equilibrium of simple water-salt system, this article put forward a new method and give the program of it.
叙述了用等压似三元相图计算尿素工艺中减压加热分解工序中的甲铵分解率、总氨蒸出率以及分解后的气液组成的方法。
The nomograms provided can be used to calculate the above parameters under the conditions of various decomposition pressures and heating temperatures in the traditional aqueous solution…
计算所得相图数据与实验结果一致。
Calculated phase diagrams are identical with the experimental data.
为了开发低共熔组成酮麝香、二甲苯麝香混合物溶液结晶新过程，计算得到酮麝香、二甲苯麝香、溶剂三元相图。
In order to develop a new solution crystallization process to separate the eutectics of musk ketone and musk xylene, the ternary phase diagrams of musk ketone, musk xylene and solvent were calculated.
文中列有计算框图及对数种相图的计算结果。
The flowchart and the calculating results of several phase diagrams…
相图计算已经成为材料设计、冶金和化工等过程模拟的重要工具，越来越受到人们的重视。
As an important approach for processing simulation in materials design, metallurgy and chemical engineering, CALPHAD approach attracts more and more attention.
并给出了微观计算流程图，这种数值方法可以方便地与宏观计算、相图计算相耦合。
The flow chart for the micro calculation which can be coupled easily with macro calculation and calculation of phase diagrams were also provided.
文中列有计算框图及对数种相图的计算结果。
文中列有计算框图及对数种相图的计算结果。
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