Abstract
We discuss the origin of the finite-size error of the energy in many-body simulation of systems of charged particles and we propose a correction based on the random-phase approximation at long wavelengths. The correction is determined mainly by the collective charge oscillations of the interacting system. Finite-size corrections, both on kinetic and potential energy, can be calculated within a single simulation. Results are presented for the electron gas and silicon.
| Original language | English (US) |
|---|---|
| Article number | 076404 |
| Journal | Physical review letters |
| Volume | 97 |
| Issue number | 7 |
| DOIs | |
| State | Published - 2006 |
ASJC Scopus subject areas
- General Physics and Astronomy
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