计算中,用半经验方法确定了分子轨道系数。
The molecular orbital coefficients are determined by means of a semiempirical method in the calculation.
对固体废弃物的气化处理半经验模型进行了研究。
This paper mainly researches on the semi-empirical model of municipal solid waste treatment.
作者还用同样方法提出了回正力矩的新半经验模型。
Also a new semi-empirical model for tire alignment torque is also given using the same method.
还给出了偶极层电容和电极问射频耦合电容半经验公式。
This paper also presented a semiempirical relationship of dipolar layer capacitance and coupling capacitance.
该法容易应用到各种半经验的和从头计算量子化学的方法中去。
It is very easy to apply this optimization approach to various semi-empirical and ab initio molecular orbital calculation.
根据理论分析和实验结果得到了预测过渡沸腾换热的半经验公式。
A prediction correlation of transition boiling heat transfer was obtained by means of theoretical analysis and by using experimental data.
常用的颗粒级配方法主要是半经验法,依靠实验来确定,工作量大。
Generally used particle grade technique is semi empirical method, it determines results according to experiments, which needs quite an amount of work.
并在此基础上总结了半经验公式,可用于肟化塔的设计和操作分析。
The semi-empirical correlations were proposed based on the experimental data, which could be used for operation analysis of the oxime tower.
摘要:改进了传统的翼型湍流边界层尾缘噪声bpm半经验预测公式。
Abstract: The traditional BPM semi-empirical prediction airfoil turbulent boundary layer trailing edge noise was improved.
提出的计算凹度的半经验公式,经过实践考验证明具有一定的实用价值。
Experimental investigations show that the semiempirical concavity calculation formulation given here are practical.
本文导出一种新的半经验的离子晶体的零温物态方程,它具有解析形式。
A new semi-experimentally zero-temperature equation of state with analytical form for ionic crystals is derived in this paper.
作者认为选择间隔时间的半理论、半经验公式可能更科学、更接近实际。
The author believes that using half-theoretical and half-practical formulas to select delay interval is probably more scientific and more approaching the practice.
传统的基于半经验半理论的离心泵的设计和研制开发,费用高、周期长。
It is high expense and long period to design and research and develop new typical Centrifugal Pump in traditional and half empirical and half theoretical way.
本文使用AM 1半经验量子化学计算研究了苯环在PEEK链内的运动。
In this paper AM1 semiempirical quantum chemical calculation was used to study the motion of phenyl rings in PEEK chains.
采用半公式半经验的方法,即“等效弹性当量系数法”计算出冻胀力的量值。
The magnitude of frost heave force is figured out by means of the half formula and half experience, namely the Equivalent Elasticity Coefficient Method.
从试验结果建立了描述浆体掺入粗颗粒后泥浆体流变参数变化的半经验关系。
Based on the experimental results, a semi-empirical relation is established for describing the variation of Theological parameter of the new mixture after coarse grains being added to the slurry.
采用一个半经验模式利用垂测数据计算了磁暴效应引起的有效热层子午向中性风。
Baed on the ionosonde data, we used an empirical method to derive the neutral meridional wind during tile storm.
首次采用AM1半经验量子化学计算方法研究了10种D型和L型氨基酸的电子结构。
The electronic structures of 10 kinds of D-form and L-form amino acids have been investigated by employing AM1 semiempirical quantum chemical method firstly.
目前主要有三种模型用来描述谷物的干燥过程,即经验模型、半经验模型和理论模型。
There are three kinds of mathematical models for describing the process i. e. the empirical, the semi-empirical and the theoretical models.
用半经验am 1方法研究了C _(60)与单态二氯卡宾环加成反应的反应机理。
The cycloaddition reaction of dichlorocarbene with C60 has been studied by using the semi-empirical method AM1. A reasonable mechanism of the reaction has been suggested.
本文作者推导了船体行驶阻力的半经验公式,并用此公式计算不同情况下的行驶阻力。
In this paper, a semi-empirical formula for the travel resistance of the boat body was derived and the travel resistance in different specified conditions were calculated.
应用半经验、半理论的方法,提出了一种符合工程设计实际的水泵性能预测与分析方法。
A method, which is based on both experience and theory, to predict and analyze pump performance is presented.
本文提出了使用半经验半理论方法对山区各气候要素的空间分布进行数学模拟的有效方法。
In this paper, an effective method of simulating the distributions of climatic elements in mountainous areas by using semiempirical theory is presented.
对电子结构计算中常用的量子化学从头算方法及几种量子化学半经验计算方法进行了讨论。
This paper discusses the quantum chemistry ab initio calculation method and some semi-empirical calculation methods frequently used on the electronic structure.
根据不同工况实验得到的功耗实验数据,经回归分析得到了吸收器功率消耗的半经验公式。
According to the experimental data on the varied operating conditions, the conventional formula for consumed power of the pilot test absorber was established.
对硝基芳烃类衍生物进行半经验分析轨道MNDO计算,求得全优化几何构型和电子结构。
Semiempirical calculations at the MNDO level were performed on nitroaromatic compounds to obtain fully optimized geometries and electronic structures.
从流动细节上看,半经验法给出时均流动与代表实际流动的时间精确解平均结果有一定差距。
Result shows that semi-empirical approach can give a good performance representation of averaged time-accurate solution.
通过分析文献实验数据得出了在整个凝固过程中传热系数与空气隙成反比的半经验耦合表达式。
A semiempirical inverse equation was used to characterize the HTC-air gap relation across the whole stages for experimental data from literature.
通过分析文献实验数据得出了在整个凝固过程中传热系数与空气隙成反比的半经验耦合表达式。
A semiempirical inverse equation was used to characterize the HTC-air gap relation across the whole stages for experimental data from literature.
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