词语大全 energy atomic中文翻譯

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词语大全 energy atomic中文翻譯

The main work of this thesis is to study of electronic structure of cathode material . some structure paramters , such as total energy , atomic charge , atomic overlap population , of the model p5mn4o83 + , p5mn12o24 - , p7co6o2015 - , p7ni6o2015 - , p5mn2co2o83 + , p5mn2ni2o8 are calculated
論文重點研究了正極材料電子結構,通過對尖晶石型錳系材料模型p5mn4o83 +和p5mn12o24 -和層狀結構的p7co6o2015 - 、 p7ni6o2015 -模型以及摻雜模型p5mn2co2o83 + 、 p5mn2ni2o8的計算,得到了各個原子簇體系的總能量、凈電荷分布、原子重疊布居值。

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