THEORY OF SELF-TRAPPED HOLE IN CAF2

被引:19
作者
JETTE, AN
DAS, TP
机构
[1] Applied Physics Laboratory, Johns Hopkins University, Silver Spring
[2] Department of Physics, University of California, Riverside
来源
PHYSICAL REVIEW | 1969年 / 186卷 / 03期
关键词
D O I
10.1103/PhysRev.186.919
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Using a classical calculation of the lattice-distortion and polarization energies along with the self-consistent-field molecular-orbital (SCF-MO) results for the energies of F2-, the configurational coordinate potential curves are obtained for the ground and excited states of the VK center in CaF2. From these curves, the optical-absorption frequencies and widths are determined, and the hyperfine constants, calculated with the SCF-MO wave functions, are given for the internuclear distance corresponding to the minimum of the ground-state potential curve. The results are compared with experiment, and the similarities between CaF2 and LiF are noted. © 1969 The American Physical Society.
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页码:919 / &
相关论文
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