This work was supported by the National High-Technology Research and Development Program of China(863 Program,Grant No.2002AA324050);the Natural Science Foundation of Shandong Province(Grant Nos.Y2002D9 and Y2004A10).
The electronic density of states, spin- splittings and atomic magnetic moments of the six- member ring N2C4 cluster with folding configuration in DNA bases have been studied by spin-polarized MS-Xα method. The result...
the National 863 High Technology Research and Development Program of China (Grant No. 2002AA324050); and the Natural Science Foundation of Shandong Province (Grant Nos. Y2002D9 , Y2004A10).
Electronic structure of SmCo7-xTix alloy has been studied by means of the spin-polarized MS-Xα method. It is shown that a few of electrons are transferred to Sm(5d) orbital due to orbital hybridization between Sm and...
supported by the National High Technology Research and Development Program of China(863 Program,Grant No.2002AA324050);by the Natural Science Foundation of Shandong Province(Grant Nos.Y2002D9 and Y2004A10).
The electronic density of states, spin-splittings and atomic magnetic moments of SmCo 7 compound have been studied using spin-polarized MS-Xα method. The results show that a few of electrons are transferred to Sm(5d ...