Correlation functions for time-dependent calculation of linear-response functions

Physics – Condensed Matter – Statistical Mechanics

Scientific paper

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to be published in Phys.Rev.E 01 Dec 1997, 2 pages, 4 figures, more information at http://espero.riken.go.jp/

Scientific paper

10.1103/PhysRevE.56.7318

We emphasize the importance of choosing an appropriate correlation function
to reduce numerical errors in calculating the linear-response function as a
Fourier transformation of a time-dependent correlation function. As an example
we take dielectric functions of silicon crystal calculated with a
time-dependent method proposed by Iitaka et al. [Phys. Rev. E 56, 1222 (1997)].

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