摘要
By using the linear combination of the AGP(antisymmetrtzed geminat power) and SPG(sequential product of geminats) functions, an attempt has been made to catcutate the ground state of the LiH molecule. The calculated results show that-the AGP or SPG function gives the same ground state result as their linear combination.
By using the linear combination of the AGP(antisymmetrtzed geminat power) and SPG(sequential product of geminats) functions, an attempt has been made to catcutate the ground state of the LiH molecule. The calculated results show that-the AGP or SPG function gives the same ground state result as their linear combination.
基金
Supported by the National Natural Science Foundation of China
