中高能正电子被CO,HCl,NH_3及SiH_4散射的总截面

Total cross sections for scattering of positron from CO,HCl,NH_3 and CH_4 at intermediate and high energies

利用可加性规则,使用Hartree-Fock波函数,采用由束缚原子概念修正过的复光学势(由静电势、极化势及吸收势三部分组成),在30—3000eV内对正电子被CO,HCl,NH3和SiH4散射的总截面进行了计算,且将计算结果与实验结果及其他理论计算结果进行了比较.结果表明,利用被束缚原子概念修正过的复光学势及可加性规则进行计算,所得结果与实验结果的符合程度要比利用未被束缚原子概念修正的复光学势及可加性规则进行计算得到的结果好很多.因此,在复光学势中采用束缚原子概念可提高正电子被分子散射的总截面的计算准确度.

A complex optical model potential modified by incorporating the concept of bonded atom, which takes into consideration the overlapping effect of electron clouds between two atoms in a molecule, is firstly employed to calculate the total cross sections for positron scattering from CO, HCl, NH3, SiH4 in the incident energy range 30-3000eV by using additivity rule model at Hartree-Fock level. In the study, the complex optical model potential composed of static, correlation polarization plus absorption contributions firstly uses the bonded-atom concept. The results of quantitative molecular total cross sections are compared with those obtained by experiments and other theories wherever available, and good agreement is obtained. It is shown that the additivity rule model together with the complex optical potential model modified by incorporating the concept of bonded atom can give much better calculation results than the unmodified one.