Fuyuki Shimojo - researchr alias

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Viewing Publication 1 - 19 from 19

2025

Multiscale Light-Matter Dynamics in Quantum Materials: From Electrons to Topological SuperlatticesTaufeq Mohammed Razakh, Thomas Linker, Ye Luo, Nariman Piroozan, Simon John Pennycook, Nalini Kumar, Albert Musaelian, Anders Johansson, Boris Kozinsky, Rajiv K. Kalia, Priya Vashishta, Fuyuki Shimojo, Shinnosuke Hattori, Ken-ichi Nomura, Aiichiro Nakano. sc 2025: 36-47 [doi]

2024

Construction of machine-learning interatomic potential under heat flux regularization and its application to power spectrum analysis for silver chalcogenidesKohei Shimamura, Akihide Koura, Fuyuki Shimojo. cphysics, 294:108920, January 2024. [doi]

2021

Ex-NNQMD: Extreme-Scale Neural Network Quantum Molecular DynamicsPankaj Rajak, Anikeya Aditya, Shogo Fukushima, Rajiv K. Kalia, Thomas Linker, Kuang Liu, Ye Luo, Aiichiro Nakano, Ken-ichi Nomura, Kohei Shimamura, Fuyuki Shimojo, Priya Vashishta. ipps 2021: 943-946 [doi]

2020

Quantum Dynamics at Scale: Ultrafast Control of Emergent Functional MaterialsSubodh C. Tiwari, Aravind Krishnamoorthy, Pankaj Rajak, Putt Sakdhnagool, Manaschai Kunaseth, Fuyuki Shimojo, Shogo Fukushima, Aiichiro Nakano, Ye Luo, Rajiv K. Kalia, Ken-ichi Nomura, Priya Vashishta. hpcasia 2020: 1-10 [doi]

2019

2015

Quantum Molecular Dynamics in the Post-Petaflops EraNichols A. Romero, Aiichiro Nakano, Katherine Riley, Fuyuki Shimojo, Rajiv K. Kalia, Priya Vashishta, Paul C. Messina. Computer, 48(11):33-41, 2015. [doi]

2014

Metascalable Quantum Molecular Dynamics Simulations of Hydrogen-on-DemandKen-ichi Nomura, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta, Kohei Shimamura, Fuyuki Shimojo, Manaschai Kunaseth, Paul C. Messina, Nichols A. Romerod. sc 2014: 661-673 [doi]

2013

Large nonadiabatic quantum molecular dynamics simulations on parallel computersFuyuki Shimojo, Satoshi Ohmura, Weiwei Mou, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta. cphysics, 184(1):1-8, 2013. [doi]

2011

Real-space investigation of a transverse wave in a liquid system generated by a molecular-dynamics simulationShuji Munejiri, Fuyuki Shimojo, Kozo Hoshino. cphysics, 182(1):58-61, 2011. [doi]

2009

A metascalable computing framework for large spatiotemporal-scale atomistic simulationsKen-ichi Nomura, Richard Seymour, Weiqiang Wang, Hikmet Dursun, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta, Fuyuki Shimojo, Lin H. Yang. ipps 2009: 1-10 [doi]

2008

De Novo Ultrascale Atomistic Simulations On High-End Parallel SupercomputersAiichiro Nakano, Rajiv K. Kalia, Ken-ichi Nomura, Ashish Sharma, Priya Vashishta, Fuyuki Shimojo, Adri C. T. van Duin, William A. Goddard, Rupak Biswas, Deepak Srivastava, Lin H. Yang. ijhpca, 22(1):113-128, 2008. [doi]

2005

Embedded divide-and-conquer algorithm on hierarchical real-space grids: parallel molecular dynamics simulation based on linear-scaling density functional theoryFuyuki Shimojo, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta. cphysics, 167(3):151-164, 2005. [doi]

2003

Scalability of a Low-Cost Multi-Teraflop Linux Cluster for High-End Classical Atomistic and Quantum Mechanical SimulationsHideaki Kikuchi, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta, Fuyuki Shimojo, Subhash Saini. ipps 2003: 66 [doi]

2002

2001

2000

A scalable molecular-dynamics algorithm suite for materials simulations: design-space diagram on 1024 Cray T3E processorsFuyuki Shimojo, Timothy Campbell, Rajiv K. Kalia, Aiichiro Nakano, Priya Vashishta, Shuji Ogata, Kenji Tsuruta. fgcs, 17(3):279-291, 2000. [doi]

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