activity
19952023
most citedFrequency-dependent local interactions and low-energy effective models from electronic structure calculations

793 citations · 10.5k across the 194 of their papers we have counts for

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Showing 2021Show all

5 papers · 1 filter

physics.comp-ph2021★ 31 cited

Order- orbital-free density-functional calculations with machine learning of functional derivatives for semiconductors and metals

Fumihiro Imoto, Masatoshi Imada, Atsushi Oshiyama

Orbital-free density functional theory (OFDFT) offers a challenging way of electronic-structure calculations scaled as computation for system size . We here dev…

physics.comp-ph2021★ 2 cited

Optimized Implementation for Calculation and Fast-Update of Pfaffians Installed to the Open-Source Fermionic Variational Solver mVMC

RuQing G. Xu, Tsuyoshi Okubo, Synge Todo +1

In this article, we present a high performance, portable and well templated implementation for computing and fast-updating Pfaffian and inverse of an even-ranked skew-symmetric (an…

cond-mat.str-el2021★ 16 cited

Charge Order and Superconductivity as Competing Brothers in Cuprate High- Superconductors

Masatoshi Imada

Studies on the interplay between the charge order and the -wave superconductivity in the copper-oxide high superconductors are reviewed with a special emphasis on th…

cond-mat.str-el2021★ 18 cited

Ab initio Derivation of Low-Energy Hamiltonians for Systems with Strong Spin-Orbit Interaction and Its Application to Ca5Ir3O12

Maxime Charlebois, Jean-Baptiste Morée, Kazuma Nakamura +7

We present an ab initio derivation method for effective low-energy Hamiltonians of material with strong spin-orbit interactions. The effective Hamiltonian is described in terms of…

cond-mat.str-el2021★ 6 cited

Resonant Inelastic X-Ray Scattering Spectra of Cuprate Superconductors Predicted by Model of Fractionalized Fermions

Masatoshi Imada

We theoretically analyze the intensity of the resonant inelastic X-ray scattering (RIXS) based on Ansatz that the electron is fractionalized into two components. By fitting the ang…