236 citations · 799 across the 14 of their papers we have counts for
14 papers
Aspect-oriented Programming with Julia
Osamu Ishimura, Yoshihide Yoshimoto
This paper proposes integrating Aspect-oriented Programming (AOP) into Julia, a language widely used in scientific and High-Performance Computing (HPC). AOP enhances software modul…
Extended Ensemble Molecular Dynamics for Thermodynamics of Phases
Gang Seob Jung, Yoshihide Yoshimoto, Kwang Jin Oh +1
The first-order phase transitions and related thermodynamics properties are primary concerns of materials sciences and engineering. In traditional atomistic simulations, the phase…
Aspect-Oriented Programming based building block platform to construct Domain-Specific Language for HPC application
Osamu Ishimura, Yoshihide Yoshimoto
The world of HPC systems is changing to a more complicated system because the performance improvement of processors has been slowed down. One of the promising approaches is Domain-…
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…
RESPACK: An ab initio tool for derivation of effective low-energy model of material
Kazuma Nakamura, Yoshihide Yoshimoto, Yusuke Nomura +6
RESPACK is a first-principles calculation software for evaluating the interaction parameters of materials and is able to calculate maximally localized Wannier functions, response f…
Formation of 2D single-component correlated electron system and band engineering in the nickelate superconductor NdNiO2
Yusuke Nomura, Motoaki Hirayama, Terumasa Tadano +3
Motivated by the recent experimental discovery of superconductivity in the infinite-layer nickelate Nd0.8Sr0.2NiO2 [Li et al., Nature 572, 624 (2019)], we study how the correlated…