613 research outputs found
Absence of Translational Symmetry Breaking in Nonmagnetic Insulator Phase on Two-Dimensional Lattice with Geometrical Frustration
The ground-state properties of the two-dimensional Hubbard model with
nearest-neighbor and next-nearest-neighbor hoppings at half filling are studied
by the path-integral-renormalization-group method. The nonmagnetic-insulator
phase sandwiched by the the paramagnetic-metal phase and the
antiferromagnetic-insulator phase shows evidence against translational symmetry
breaking of the dimerized state, plaquette singlet state, staggered flux state,
and charge ordered state. These results support that the genuine Mott insulator
which cannot be adiabatically continued to the band insulator is realized
generically by Umklapp scattering through the effects of geometrical
frustration and quantum fluctuation in the two-dimensional system.Comment: 4 pages and 7 figure
Completely localized gravity with higher curvature terms
In the intersecting braneworld models, higher curvature corrections to the
Einstein action are necessary to provide a non-trivial geometry (brane tension)
at the brane junctions. By introducing such terms in a Gauss-Bonnet form, we
give an effective description of localized gravity on the singular
delta-function branes. There exists a non-vanishing brane tension at the
four-dimensional brane intersection of two 4-branes. Importantly, we give
explicit expressions of the graviton propagator and show that the
Randall-Sundrum single-brane model with a Gauss-Bonnet term in the bulk
correctly gives a massless graviton on the brane as for the RS model. We
explore some crucial features of completely localized gravity in the solitonic
braneworld solutions obtained with a choice (\xi=1) of solutions. The no-go
theorem known for Einstein's theory may not apply to the \xi=1 solution. As
complementary discussions, we provide an effective description of the power-law
corrections to Newtonian gravity on the branes or at the common intersection
thereof.Comment: 19 pages, LaTeX, Revised/Published Versio
First-Principles Computation of YVO3; Combining Path-Integral Renormalization Group with Density-Functional Approach
We investigate the electronic structure of the transition-metal oxide YVO3 by
a hybrid first-principles scheme. The density-functional theory with the
local-density-approximation by using the local muffin-tin orbital basis is
applied to derive the whole band structure. The electron degrees of freedom far
from the Fermi level are eliminated by a downfolding procedure leaving only the
V 3d t2g Wannier band as the low-energy degrees of freedom, for which a
low-energy effective model is constructed. This low-energy effective
Hamiltonian is solved exactly by the path-integral renormalization group
method. It is shown that the ground state has the G-type spin and the C-type
orbital ordering in agreement with experimental indications. The indirect
charge gap is estimated to be around 0.7 eV, which prominently improves the
previous estimates by other conventional methods
Nonmagnetic Insulating States near the Mott Transitions on Lattices with Geometrical Frustration and Implications for -(ET)Cu
We study phase diagrams of the Hubbard model on anisotropic triangular
lattices, which also represents a model for -type BEDT-TTF compounds.
In contrast with mean-field predictions, path-integral renormalization group
calculations show a universal presence of nonmagnetic insulator sandwitched by
antiferromagnetic insulator and paramagnetic metals. The nonmagnetic phase does
not show a simple translational symmetry breakings such as flux phases,
implying a genuine Mott insulator. We discuss possible relevance on the
nonmagnetic insulating phase found in -(ET)Cu.Comment: 4pages including 7 figure
Transcriptional Robustness Complements Nonsense-Mediated Decay in Humans
In eukaryotes, gene expression is a complex, multi-step process involving transcription, splicing, translation, and post-translational modifications. At each individual step, errors can occur that lead to nonfunctional and potentially toxic proteins. Therefore, eukaryotes have evolved a wide array of solutions to minimize the risk of error.This work was supported by NIH grant R01 GM088344 to COW. The funder had no role in the preparation of the article.Cellular and Molecular Biolog
Ground State Properties and Optical Conductivity of the Transition Metal Oxide
Combining first-principles calculations with a technique for many-body
problems, we investigate properties of the transition metal oxide from the microscopic point of view. By using the local density
approximation (LDA), the high-energy band structure is obtained, while screened
Coulomb interactions are derived from the constrained LDA and the GW method.
The renormalization of the kinetic energy is determined from the GW method. By
these downfolding procedures, an effective Hamiltonian at low energies is
derived. Applying the path integral renormalization group method to this
Hamiltonian, we obtain ground state properties such as the magnetic and orbital
orders. Obtained results are consistent with experiments within available data.
We find that is close to the metal-insulator transition.
Furthermore, because of the coexistence and competition of ferromagnetic and
antiferromgnetic exchange interactions in this system, an antiferromagnetic and
orbital-ordered state with a nontrivial and large unit cell structure is
predicted in the ground state. The calculated optical conductivity shows
characteristic shoulder structure in agreement with the experimental results.
This suggests an orbital selective reduction of the Mott gap.Comment: 38pages, 22figure
rac-Ethyl 6-hyÂdroxy-6-methyl-3-oxo-4-phenyl-1,3,4,5,6,7-hexaÂhydroÂbenzo[c][1,2]oxazole-5-carboxylÂate
In the title compound, C17H19NO5, the cycloÂhexene ring is in a half-chair conformation and the isoxazole ring in an envelope conformation with the N atom as the flap. The C atoms in the 4- and 6-positions are of the same absolute configuration, whereas the C atom in the 5-position is of the opposite configuration, i.e. (4S*,5R*,6S*). The methyl fragment of the ethÂoxyÂcarbonyl group at position 5 is disordered over two sets of sites in a 0.60:0.40 ratio. The crystal packing displays interÂmolecular N—H⋯O and O—H⋯O hydrogen bonds
Ab initio Derivation of Low-energy Model for Iron-Based Superconductors LaFeAsO and LaFePO
Effective Hamiltonians for LaFeAsO and LaFePO are derived from the
downfolding scheme based on first-principles calculations and provide insights
for newly discovered superconductivity in the family of LnFeAsOF,
Ln = La, Ce, Pr, Nd, Sm, and Gd. Extended Hubbard Hamiltonians for five
maximally localized Wannier orbitals per Fe are constructed dominantly from
five-fold degenerate iron-3 bands. They contain parameters for effective
Coulomb and exchange interactions screened by the polarization of other
electrons away from the Fermi level. The onsite Coulomb interaction estimated
as 2.2-3.3 eV is compared with the transfer integrals between the
nearest-neighbor Fe-3 Wannier orbitals, 0.2-0.3 eV, indicating moderately
strong electron correlation. The Hund's rule coupling is found to be 0.3-0.6
eV. The derived model offers a firm basis for further studies on physics of
this family of materials. The effective models for As and P compounds turn out
to have very similar screened interactions with slightly narrower bandwidth for
the As compound.Comment: 5 pages, 3 figures, 1 table; to appear in J. Phys. Soc. Jpn. Vol. 77
No.9: Revised version contains corrected table values and discussions of
quantitative accuracy of constrained random-phase approximatio
A rigorous treatment of the perturbation theory for many-electron systems
Four point correlation functions for many electrons at finite temperature in
periodic lattice are analyzed by the perturbation theory with respect to the
coupling constant. The correlation functions are characterized as a limit of
finite dimensional Grassmann integrals. A lower bound on the radius of
convergence and an upper bound on the perturbation series are obtained. The
perturbation series up to second order is numerically implemented along with
the volume-independent upper bounds on the sum of the higher order terms in 2
dimensional case.Comment: 61 page
Gossamer Superconductor, Mott Insulator, and Resonating Valence Bond State in Correlated Electron Systems
Gutzwiller variational method is applied to an effective two-dimensional
Hubbard model to examine the recently proposed gossamer superconductor by
Laughlin. The ground state at half filled electron density is a gossamer
superconductor for smaller intra-site Coulomb repulsion U and a Mott insulator
for larger U. The gossamer superconducting state is similar to the resonant
valence bond superconducting state, except that the chemical potential is
approximately pinned at the mid of the two Hubbard bands away from the half
filled
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