supported by the National Natural Science Foundation of China (Grant Nos. 10974138 and 10774103)
This paper presents the complete energy matrix of the 3d2system containing the electron-electron interaction, the ligand-fieldinteraction, the spin-orbit coupling interaction, and the Zeeman interaction, in which the ...
Project supported by the National Natural Science Foundation of China (Grant No 10774103);the Doctoral Education Fund of Education Ministry of China (Grant No 20050610011)
A simple theoretical method is introduced for studying the interrelation between electronic and molecular structures.By diagonalizing the 120 × 120 complete energy matrices,the relationships between zero-field splitt...
Project supported by the National Natural Science Foundation of China (Grant No 10774103);the Doctoral Education Fund of the Education Ministry of China (Grant No 20050610011)
By simulating the electron paramagnetic resonance (EPR) and optical spectra on the basis of the 120 × 120 complete energy matrix, this paper determines the local lattice structure parameters R1 and R2 for MCl:V2+...