Competitions in layered ruthenates: ferro- vs. antiferromagnetism and triplet vs. singlet pairing

Abstract

Ru based perovskites demonstrate an amazing richness in their magnetic properties, including 3D and quasi-2D ferromagnetism, antiferromagnetism, and unconventional superconductivity. Tendency to ferromagnetism, stemming from the unusually large involvement of O in magnetism in ruthenates, leads to ferromagnetic spin fluctuations in Sr2RuO4 and eventually to p-wave superconductivity. A related compound Ca2RuO4 was measured to be antiferromagnetic, suggesting a possibility of antiferromagnetic fluctuations in Sr2RuO4 as well. Here we report first principles calculations that demonstrate that in both compounds the ferro- and antiferromagnetic fluctuations coexist, leading to an actual instability in Ca2RuO4 and to a close competition between p-wave and d-wave superconducting symmetries in Sr2RuO4. The antiferromagnetism in this system appears to be mostly related with the nesting, which is the strongest at Q=(2pi/3,2pi/3,0). Surprisingly, for the Fermiology of Sr2RuO4 the p-wave state wins over the d-wave one everywhere except in close vicinity of the antiferromagnetic instability. The most stable state within the d-wave channel has vanishing order parameter at one out of three Fermi surfaces in Sr2RuO4, while in the p channel its amplitude is comparable at all three of them.