Related papers: Overhauser's spin-density wave in exact-exchange s…
Unconventional charge and spin density-wave states are commonly observed in bilayer nickelates, drawing considerable attention due to their proximity to high-$T_c$ superconductivity in various phase diagrams. However, the nature and…
The present work proposes to use density-functional theory (DFT) to correct for the basis-set error of wave-function theory (WFT). One of the key ideas developed here is to define a range-separation parameter which automatically adapts to a…
We have investigated the collective modes of unconventional charge and spin density waves (UCDW, USDW) in quasi-one dimensional systems in random phase approximation. The density correlator regains its normal state form due to the phase…
The spin density wave and its temperature dependence in oxypnictide are studied in a three-band model. The spin susceptibilities with various interactions are calculated in the random phase approximation(PPA). It is found that the spin…
Spontaneous breaking of translational symmetry---known as `density wave' order---is common in nature. However such states are strongly sensitive to impurities or other forms of frozen disorder leading to fascinating glassy phenomena. We…
We propose a novel spin density wave (SDW) state as a possible mechanism of the anomalous antiferromagnetism, so-called the micromagnetism, in URu_2Si_2 below 17.5[K]. In this new SDW, the electron-hole pair amplitude changes its sign in…
We study collective spin excitations of a magnetically ordered state in a multi-component system composed of both itinerant electrons and local moments. Here the induced spin-density-wave (SDW) ordering of itinerant electrons and the…
For the computational prediction of core electron binding energies in solids, two distinct kinds of modelling strategies have been pursued: the $\Delta$-Self-Consistent-Field method based on density functional theory (DFT), and the GW…
We propose a mechanism to use inelastic tunneling spectrosopy STM to detect a single spin in a d-wave superconductor and in a pseudogap state, based on a direct exchange coupling J between the surface electrons and the local spin S in a…
Typical density functional theory (DFT) and approximations thereto solve the many-electron ground state problem by working from a numerically efficient non-interacting Kohn-Sham reference system; and benefit from useful minimization…
A theory of Kondo lattices is applied to studying possible magnetic and charge structures of itinerant-electron antiferromagnets. Even helical spin structures can be stabilized when the nesting of the Fermi surface is not sharp and the…
Ground-state electronic structure calculations using Kohn-Sham density functional theory (KS-DFT) offer an unprecedented balance between efficiency and accuracy, now paradigmatic to the fields of quantum chemistry and condensed matter…
We present an analytic theory unraveling the microscopic mechanism of instabilities within interacting $D$-dimensional Fermi liquid. Our model consists of a $D$-dimensional electron gas subject to an instantaneous electron-electron…
We study the instabilities of a particle-hole symmetric Weyl metal with both electron and hole Fermi surfaces (FS) around the Weyl points. For a repulsive interaction, we find that the leading instability is towards a longitudinal…
A strict bidimensional (strict-2D) exact-exchange (EE) formalism within the framework of density-functional theory (DFT) has been developed and applied to the case of an electron gas subjected to a strong perpendicular magnetic field, that…
A recent discovery of the pair density wave (PDW) order creates a stir in understanding an underlying physics in the pseudogap states of the cuprate high temperature superconductors. We have performed a Spectroscopic Imaging Scanning…
It is shown that, contrary to widely held beliefs, the potentials of spin-density-functional theory (SDFT) are not unique functionals of the spin densities. Explicit examples of distinct sets of potentials with the same ground-state…
We develop a method in which the electronic densities of small fragments determined by Kohn-Sham density functional theory (DFT) are embedded using stochastic DFT to form the exact density of the full system. The new method preserves the…
A robust theory of the mechanism of pair density wave (PDW) superconductivity (i.e. where Cooper pairs have nonzero center of mass momentum) remains elusive. Here we explore the triangular lattice $t$-$J$-$V$ model, a low-energy effective…
Using the quasiclassical Green's function formalism, we study the influence of the odd-frequency spin-triplet superconductivity on the local density of states (LDOS) in a diffusive ferromagnet (DF) attached to a superconductor. Various…