initio的例句大全

The anisotropy which is neglected in CFT calculations is considered in ab initio ones.

进一步计算杂质Cr3十进入A12O3后对周围晶格的影响,发现Cr3+对其第三近邻原子的影响仍不可忽略.

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The agreement was declared void ab initio.

此协议自一开始就被宣布无效。

《牛津高阶英汉双解词典》

We assume that the sex of the lion is ab initio _ indeterminate.

我们假设狮子的性别在一开始是不确定的.

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These four parameters, and b are calculated by ab initio method in this paper.

本论文针对上述四个重要的参数作了量子力学的从头计算.

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The energy bands and density of states were calculated using the VASP ab-initio simulation package program.

在此基础上计算了化合物的能带结构和电子能态密度.

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The later one, named as ab initio prediction method, can forecast the recognition sequence independently.

基于人工智能的方法又称从头预测算法, 可相对独立地对待识别序列进行预测.

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The structure changes of forced out PPS were analyzed with ab initio calculation.

通过量子化学计算,对挤出后PPS结构变化进行了理论分析.

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An invalid or canceled contract is not legally binding ab initio.

第五十六条无效的合同或者被撤销的合同自始没有法律约束力.

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Ab Initio Studies on Some Borane Ions and Their Derivatives

一些硼烷离子及其衍生物的理论研究

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An Ab Initio MO Study of the Microscopic Branching Mechanism for Reaction H+ ClF → HCl+ F

H+ClF→HCl+F微观分支反应机理的从头算分子轨道法研究

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Effect of External Electric Field in Electron Transfer An Ab Initio Calculation for Electron Transfer Between Benzene and Benzene Cation Radical

电子转移的外电场效应&苯分子与苯正离子自由基间电子转移的从头算研究

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An ab initio calculation was performed on the study of electronic states of MoCl_2~ ( 2+) and MoCl_4 using relativistic effective core potential ( RECP) for molybdenum, and non-relativistic ECP for chlorine.

应用相对论等效实势（ECP）从头计算方法（HF+CI）研究了钼原子簇碎片MoCl2~（2+）和MoCl4的电子结构及其反应活性。

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The program of Ab Initio LCAO SCF MO Calculations Using GTF as Basis Sets

以高斯函数为基组的自洽场分子轨道从头计算程序

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