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双原子分子振动能谱的再计算
Recalculating vibrational Energy of diatomic molecules
【摘要】 对势模型进行变形,借助超维里定理和Hellman-Feyman定理,不用求波函数,而只根据零级能量和势模型推导了无波函数微扰论的递推公式.利用这些公式和双变量的快速逼近的pad埁近似方法,计算了Hcl分子的振动能谱,计算结果与实验相符.
【Abstract】 This paper changed the potential model,derived the recurrence fourmula of the perturbation theory without wave function based on Hypervirial theorem and Hellman-Feyman theorem,then computed the vibration spectrum of Hcl molecule by using this formula and the two-variable Padè approximation method.The results are well accorded with the experimental values.
- 【文献出处】 沈阳师范大学学报(自然科学版) ,Journal of Shenyang Normal University(Natural Science) , 编辑部邮箱 ,2004年02期
- 【分类号】O561
- 【被引频次】1
- 【下载频次】76