较重的稀有气体具有较低的电离势，这也可以解释它们的化学性质。
The low ionization potentials of the heavier gases also account for their chemistry.
采用量子化学从头算的方法，对电离势、前线轨道能级和共轭能进行了计算。
Some quantum data such as ionization energy, advanced linear orbital level and conjugated energy were calculated by quantum chemical initial calculation method.
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