The best parameters of analytical wave functions were obtained by the variational methods, and the energy of every atom was systematically calculated.
采用变分法定出了解析波函数的最佳参数,对各原子的能量进行了系统的计算。
It gave the best parameters of analytical wave functions by the variational methods, and large-scale systematically calculated the energy of every atom.
采用变分法定出了解析波函数的最佳参数,并对各原子的能量进行了系统的大量计算。
By analytical and numerical calculations, stable region diagram of the energy state, wave functions and energy level shift are obtained.
通过解析与数值计算,给出了能态的稳定区图、波函数和能级移位。
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