H_4氢原子团簇结构与能量的计算

The Structure and Energy Calculations for H_4 Atomic Cluster

作者为了探索撤去高压后金属氢是否仍可能存在,将H4原子团簇正四面体空心结构的核外电子等效为类Be原子的1s态,选用两个变量波函数的变分公式,用Matlab数值分析,法计算出了它的最低能量值为:-29.1275586e0(e0为e2/a0,e电子电量,a0为氢原子的第一玻尔半径),同MACQM的计算值比较,相对误差较小,研究结果说明,由作者提出的物理模型和计算方法是有效可靠的.

To explore whether the hydrogenous exists or not when the high voltage is evacuated, the authors adopt the variational calculations methods of two variable wave functions and Consides the extra nuclear electron of the hollow structure of H4 Atomic Cluster equals the ^1sCondition of Be atom and calculates the lowest energy value： -29.1275586e0 （e0 is e2/α0） by the numerical analysis method of Matlab, so comparing it with the calculation value of MACQM method the relative error of this calculation method is less. the author considers the proposal of physics model and calculation method are valid and reliable.