Abstract
A scheme to incorporate nonlocal polarizations into the dynamical mean-field theory (DMFT) and a tailormade way to determine the effective interaction for DMFT are systematically investigated. Applying it to the two-dimensional Hubbard model, we find that nonlocal polarizations induce a nontrivial filling-dependent antiscreening effect for the effective interaction. The present scheme combined with density functional theory offers an ab initio way to derive effective on-site interactions for the impurity problem in DMFT. We apply it to SrVO3 and find that the antiscreening competes with the screening caused by the off-site interaction.
| Original language | English |
|---|---|
| Article number | 085117 |
| Number of pages | 8 |
| Journal | Physical Review B |
| Volume | 86 |
| Issue number | 8 |
| DOIs | |
| Publication status | Published - 2012 |
Austrian Fields of Science 2012
- 103009 Solid state physics
- 103015 Condensed matter
- 103025 Quantum mechanics
- 103036 Theoretical physics
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