BACK-ROTATION OF THE WAVE-FUNCTION IN THE COMPLEX SCALING METHOD

被引:34
作者
CSOTO, A [1 ]
GYARMATI, B [1 ]
KRUPPA, AT [1 ]
PAL, KF [1 ]
MOISEYEV, N [1 ]
机构
[1] TECHNION ISRAEL INST TECHNOL, DEPT CHEM, IL-32000 HAIFA, ISRAEL
来源
PHYSICAL REVIEW A | 1990年 / 41卷 / 07期
关键词
D O I
10.1103/PhysRevA.41.3469
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The complex resonance eigenvalue can easily be obtained by scaling the internal coordinates of the Hamiltonian by a complex factor since then the resonance eigenfunction, is square integrable. The back-transformation of however, yields the exact eigenfunction of the original Hamiltonian only when is given in closed form. We show here that in the case when a basis-set method is invoked, even if the limn is the exact solution of the transformed problem, the n limit of the back-rotated n may produce a divergent wave function. Our numerical examples suggest that the quality of approximation in the back-rotated wave function strongly depends on the basis set. © 1990 The American Physical Society.
引用
收藏
页码:3469 / 3477
页数:9
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