APPLICATION OF GENERALIZED MOBIUS INVERSE FOR- MULA ON PAIRWISE INTERACTION IN 3D LATTICE
修正的莫比乌斯反演公式在晶体对势计算中的应用

Chen Mobius inverse formula is further generalized. This generalized formula is applied to solve the inverse problem of pairwise interaction in 3D lattice. After discussing structural characters of several typical perfect crystals, we give an algorithm based upon iterative methed with numerical examples. Stability and error of this algorithm are analyzed.