Method for ab initio nonlinear electron-density evolution

Roi Baer, Recca Gould

Research output: Contribution to journalArticlepeer-review

50 Scopus citations


An accurate nonlinear time evolution scheme based on Chebyshev interpolation in the time domain is presented. The equation set up is an implicit integral equation. This approach enables studying complicated time-dependent electronic processes in systems such as molecular wires.

Original languageAmerican English
Pages (from-to)3385-3392
Number of pages8
JournalJournal of Chemical Physics
Issue number8
StatePublished - 22 Feb 2001


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