红外光谱数据与极化方程结合计算有效电荷的方法是研究键极化性质的较好途径。
In the article we suppose that it is a better way to study bond's polarizability that the combination of infra-red spectrum data and polarizability equation calculates effective charge.
因此,把质子结合到更可极化的气体上,会释放很多能量,利于成键。 当然,这要求有小的、电负性的共配物。
Attachment of a proton to the more polarizable gases therefore gives significant energy toward bonding.
目前已被广泛用来计算原子和分子的极化率、磁化率、总能量、键能等。
Now, it has been applied to calculating atomic and molecular polarization rate, susceptibility, total energy, bond energy etc.
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