Demonstration of initial-state dependence in time-dependent density-functional theory - art. no. 042501

Citation
Nt. Maitra et K. Burke, Demonstration of initial-state dependence in time-dependent density-functional theory - art. no. 042501, PHYS REV A, 6304(4), 2001, pp. 2501
Citations number
30
Categorie Soggetti
Physics
Journal title
PHYSICAL REVIEW A
ISSN journal
10502947 → ACNP
Volume
6304
Issue
4
Year of publication
2001
Database
ISI
SICI code
1050-2947(200104)6304:4<2501:DOIDIT>2.0.ZU;2-F
Abstract
Time-dependent density functionals depend in principle on the initial state of a system, but this is ignored in functional approximations presently in use. For one electron, it is shown that there is no initial-state dependen ce: for any density, only one initial state produces a well-behaved potenti al. For two noninteracting electrons with the same spin in one dimension, a n initial potential that makes an alternative initial wave function evolve with the same density and current as a ground state is calculated. This pot ential is well-behaved, and can be made arbitrarily different from the orig inal potential.