Electronic Structures of Antiperovskite Superconductor MgCNi3_3 and Related Compounds

Electronic structure of a newly discovered antiperovskite superconductor MgCNi$_3$ is investigated by using the LMTO band method. The main contribution to the density of states (DOS) at the Fermi energy $E_{\rm F}$ comes from Ni 3$d$ states which are hybridized with C 2$p$ states. The DOS at $E_{\rm F}$ is varied substantially by the hole or electron doping due to the very high and narrow DOS peak located just below $E_{\rm F}$. We have also explored electronic structures of C-site and Mg-site doped MgCNi$_3$ systems, and described the superconductivity in terms of the conventional phonon mechanism.Comment: 3 pages, presented at ORBITAL2001 September 11-14, 2001 (Sendai, JAPAN

Electronic structures of antiperovskite superconductors: MgXNi3_3 (X=B,C,N)

We have investigated electronic structures of a newly discovered antiperovskite superconductor MgCNi$_3$ and related compounds MgBNi$_3$ and MgNNi$_3$. In MgCNi$_3$, a peak of very narrow and high density of states is located just below $\rm E_F$, which corresponds to the $\pi^*$ antibonding state of Ni-3d and C-$2p$ but with the predominant Ni-3d character. The prominent nesting feature is observed in the $\Gamma$-centered electron Fermi surface of an octahedron-cage-like shape that originates from the 19th band. The estimated superconducting parameters based on the simple rigid-ion approximation are in reasonable agreement with experiment, suggesting that the superconductivity in MgCNi$_3$ is described well by the conventional phonon mechanism.Comment: 5 pages, 5 figure

Electronic structure of metallic antiperovskite compound GaCMn3_3

We have investigated electronic structures of antiperovskite GaCMn$_3$ and related Mn compounds SnCMn$_3$, ZnCMn$_3$, and ZnNMn$_3$. In the paramagnetic state of GaCMn$_3$, the Fermi surface nesting feature along the $\Gamma{\rm R}$ direction is observed, which induces the antiferromagnetic (AFM) spin ordering with the nesting vector {\bf Q} $\sim \Gamma{\rm R}$. Calculated susceptibilities confirm the nesting scenario for GaCMn$_3$ and also explain various magnetic structures of other antiperovskite compounds. Through the band folding effect, the AFM phase of GaCMn$_3$ is stabilized. Nearly equal densities of states at the Fermi level in the ferromagnetic and AFM phases of GaCMn$_3$ indicate that two phases are competing in the ground state.Comment: 4 pages, 5 figure

Thermal activation energy of 3D vortex matter in NaFe1-xCoxAs (x=0.01, 0.03 and 0.07) single crystals

We report on the thermally activated flux flow dependency on the doping dependent mixed state in NaFe1-xCoxAs (x=0.01, 0.03, and 0.07) crystals using the magnetoresistivity in the case of B//c-axis and B//ab-plane. It was found clearly that irrespective of the doping ratio, magnetoresistivity showed a distinct tail just above the Tc, offset associated with the thermally activated flux flow (TAFF) in our crystals. Furthermore, in TAFF region the temperature dependence of the activation energy follows the relation U(T, B)=U_0 (B) (1-T/T_c )^q with q=1.5 in all studied crystals. The magnetic field dependence of the activation energy follows a power law of U_0 (B)~B^(-{\alpha}) where the exponent {\alpha} is changed from a low value to a high value at a crossover field of B=~2T, indicating the transition from collective to plastic pinning in the crystals. Finally, it is suggested that the 3D vortex phase is the dominant phase in the low-temperature region as compared to the TAFF region in our series samples

Anomalous double peak structure in Nb/Ni superconductor/ferromagnet tunneling DOS

We have experimentally investigated the density of states (DOS) in Nb/Ni (S/F) bilayers as a function of Ni thickness, $d_F$. Our thinnest samples show the usual DOS peak at $\pm\Delta_0$, whereas intermediate-thickness samples have an anomalous ``double-peak'' structure. For thicker samples ($d_F \geq 3.5$ nm), we see an ``inverted'' DOS which has previously only been reported in superconductor/weak-ferromagnet structures. We analyze the data using the self-consistent non-linear Usadel equation and find that we are able to quantitatively fit the features at $\pm\Delta_0$ if we include a large amount of spin-orbit scattering in the model. Interestingly, we are unable to reproduce the sub-gap structure through the addition of any parameter(s). Therefore, the observed anomalous sub-gap structure represents new physics beyond that contained in the present Usadel theory.Comment: 4 pages, 3 figure

A self-tuning mechanism in (3+p)d gravity-scalar theory

We present a new type of self-tuning mechanism for ($3+p$)d brane world models in the framework of gravity-scalar theory. This new type of self-tuning mechanism exhibits a remarkable feature. In the limit $g_s \to 0$, $g_s$ being the string coupling, the geometry of bulk spacetime remains virtually unchanged by an introduction of the Standard Model(SM)-brane, and consequently it is virtually unaffected by quantum fluctuations of SM fields with support on the SM-brane. Such a feature can be obtained by introducing Neveu-Schwarz(NS)-brane as a background brane on which our SM-brane is to be set. Indeed, field equations naturally suggest the existence of the background NS-brane. Among the given such models, of the most interest is the case with $\Lambda=0$, where $\Lambda$ represents the bulk cosmological constant. This model contains a pair of coincident branes (of the SM- and the NS-branes), one of which is a codimension-2 brane placed at the origin of 2d transverse space ($\equiv \Sigma_2$), another a codimension-1 brane placed at the edge of $\Sigma_2$. These two branes are (anti) T-duals of each other, and one of them may be identified as our SM-brane plus the background NS-brane. In the presence of the background NS-brane (and in the absence of $\Lambda$), the 2d transverse space $\Sigma_2$ becomes an orbifold $R_2 /Z_n$ with an appropriate deficit angle. But this is only possible if the ($3+p$)d Planck scale $M_{3+p}$ and the string scale $M_s$($\equiv 1/\sqrt{\alpha^{\prime}}$) are of the same order, which accords with the hierarchy assumption \cite{1,2,3} that the electroweak scale $m_{EW}$ is the only short distance scale existing in nature

Charge and Orbital Ordering and Spin State Transition Driven by Structural Distortion in YBaCo_2O_5

We have investigated electronic structures of antiferromagnetic YBaCo_2O_5 using the local spin-density approximation (LSDA) + U method. The charge and orbital ordered insulating ground state is correctly obtained with the strong on-site Coulomb interaction. Co^{2+} and Co^{3+} ions are found to be in the high spin (HS) and intermediate spin (IS) state, respectively. It is considered that the tetragonal to orthorhombic structural transition is responsible for the ordering phenomena and the spin states of Co ions. The large contribution of the orbital moment to the total magnetic moment indicates that the spin-orbit coupling is also important in YBaCo_2O_5.Comment: 4 pages including 4 figures, Submitted to Phys. Rev. Let