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pdf, 9 MiB - Infoscience - EPFL

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128 CHAPTER 5. THE FLUX PHASE FOR THE CUPRATES<br />

0.008<br />

l 0<br />

=2<br />

l 0<br />

=4<br />

0.008<br />

0.004<br />

0.004<br />

0<br />

0<br />

-0.004<br />

-0.008<br />

Kinetic energy<br />

Coulomb energy<br />

Exchange energy<br />

0 1 2 3 4 5<br />

V 0<br />

-0.004<br />

0 1 2 3 4 5<br />

V 0<br />

-0.008<br />

Figure 5.9: Kinetic, exchange and Coulomb energy per site of the BO/J wavefunction<br />

minus the respective associated energy of the SFP/J wave-function.<br />

energy of the SFP/J and BO/J wave-functions. We conclude that the two<br />

wave-functions, although qualitatively similar (they both exhibit an underlying<br />

staggered flux pattern), bear quantitative differences: the staggered flux<br />

phase (slightly) better optimizes the kinetic energy whereas the bond-order wavefunction<br />

(slightly) better optimizes the Coulomb and exchange energies so that<br />

a small overall energy gain is in favor of the modulated phase. Therefore, we<br />

unambiguously conclude that, generically, bond-order modulations should spontaneously<br />

appear on top of the staggered flux pattern for moderate doping.<br />

Finally, we emphasize that the bond-order wave-function is not stabilized by<br />

the Coulomb repulsion alone (like for a usual electronic Wigner cristal) exhibiting<br />

coexisting bond order and (small) charge density wave. Moreover, the variational<br />

parameters ɛ i in Eq. (5.6) are found after minimizing the projected energy to be<br />

set to equal values on every site of the unit-cell. Let us also emphasize that<br />

the bond-order wave-function is not superconducting as proposed in some scenarios<br />

[130]. In the actual variational framework, we do not consider bond-order<br />

wave-function embedded in a sea of d-wave spin singlet pairs.<br />

Infact,wedonotexpectabulkd-waveRVBstatetobestableatlarge<br />

Coulomb repulsion (because of its very poor Coulomb energy) nor a bulk static<br />

checkerboard SFP at too small Coulomb energy. However, for moderate Coulomb<br />

repulsion for which the d-wave RVB remains globally stable, sizeable regions of<br />

checkerboard SFP could be easily nucleated e.g. by defects. This issue will be

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