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JoVE Journal
Chemistry

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来自甲流热化学分子簇的大气浓度计算
 
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来自甲流热化学分子簇的大气浓度计算

Article DOI: 10.3791/60964
April 8th, 2020

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Summary April 8th, 2020

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弱结合分子簇的大气浓度可以通过利用遗传算法和半经验量子化学的多步配置采样方法,从低能结构的热化学性质中计算。 ab initio

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