• 红外显示腐殖酸杀真菌剂之间氢键电荷转移可能吸附作用产生的机理

    IR spectra showed that H-bonds and charge-transfer bonds between humic acid and fungicides probably operated as mechanisms of adsorption.

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  • 得到电子结构包括分子轨道能量本征值密度电荷转移等等结果。

    It's electronic structure, including spectrum of the ground state valence levels, density of states, and the charge transfer between adsorbate and substrate, is obtained.

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  • 得到电子结构包括分子轨道能量本征值密度电荷转移等等结果。

    It's electronic structure, including spectrum of the ground state valence levels, density of states, and the charge transfer between adsorbate and substrate, is obtained.

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