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Fuyuki Shimojo

Kumamoto University

2-39-1 Kurokami, Chuo Ward

Kumamoto, 860-0862

Japan

  • Kumamoto University

SCHOLARLY PAPERS

2

DOWNLOADS

60

TOTAL CITATIONS

0

Scholarly Papers (2)

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1.

Atomic and Electronic Structures of an Ag-Containing 4a Zeolite

Number of pages: 20 Posted: 02 Dec 2022
Shinya Hosokawa, Kentaro Kobayashi, Akihide Koura, Fuyuki Shimojo, Yasuhisa Tezuka, Jun-ichi Adachi, Yohei Onodera, Shinji Kohara, Hiroo Tajiri, Anand Chokkalingam and Toru Wakihara
Kumamoto University, Shimane University, Kumamoto University, Kumamoto University, Hirosaki University, High Energy Accelerator Research Organization (KEK) - Institute of Materials Structure Science, Kyoto University, National Institute for Materials Science, Japan Synchrotron Radiation Research Institute, University of Tokyo and University of Tokyo
Downloads 41 (1,170,409)

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zeolites, Antibacterial function, Atomic structure, Electron density of states, DFT calculation

2.

Thermal Conductivity Calculation Using Homogeneous Non-Equilibrium Molecular Dynamics Simulation with Allegro

Number of pages: 26 Posted: 08 May 2024
Kohei Shimamura, Shinnosuke Hattori, Ken-ichi Nomura, Akihide Koura and Fuyuki Shimojo
Kumamoto University, affiliation not provided to SSRN, University of Southern California, Kumamoto University and Kumamoto University
Downloads 19 (1,459,862)

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Machine-learning interatomic potential (MLIP), Allegro, Thermal conductivity, Homogeneous non-equilibrium molecular dynamics (HNEMD), Spectral heat current (SHC), First-principles molecular dynamics (FPMD)