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Research Showcase

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First-principles Calculation of Electric Field Effects in Spin-to-charge Conversion Materials

ISSP Activity Report 2020, p. 150…Read More

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Structural analysis of surface superstructures and atomic layer materials using by 2DMAT on supercomputer system at ISSP

ISSP Activity Report 2021, p. 299-300…Read More

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Low Thermal Conductance Generated by van Der Waals Interaction

ISSP Activity Report 2021, p. 299-300…Read More

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Quantum Simulations on Dynamical Heterogeneous Catalysts

ISSP Activity Report 2020, p. 61-62…Read More

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Noisy simulations of first-principles calculations using quantum classical hybrid algorithms

ISSP Activity Report 2020, p. 147-148…Read More

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Fusion of computational material science and data-driven science with massively parallel computation

ISSP Activity Report 2020, p. 82-83…Read More

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Ab-initio simulation of electron energy distribution in an insulator excited by an intense laser pulse

ISSP Activity Report 2023, p. 134-135…Read More

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Ab initio optical calculation by RESPACK

ISSP Activity Report 2023, p. 45-52…Read More

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Equilibrium/nonequilibrium electrochemistry of disordered solid-state interfaces

ISSP Activity Report 2023, p. 81…Read More

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Implementation of Finite-Temperature Calculation in TeNeS

ISSP Activity Report 2023, p. 371-372…Read More

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App Ranking

  • Crystallography Open Database(1→)
  • VESTA(2→)
  • GSYS(3→)
  • ASM Alloy Phase Diagram Database
  • Chem3D(4↘)
  • QUANTUM ESPRESSO(7↗)
  • CASINO(9↗)
  • ORCA(20↗)
  • ALAMODE(16↗)
  • Materials Project(12↗)
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A Portal Site of Materials Science Simulation

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