Hybrid finite-element/molecular-dynamics/electronic-density-functional approach to materials simulations on parallel computers
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Publication:5944553
DOI10.1016/S0010-4655(01)00203-XzbMath1169.74624OpenAlexW2141519533MaRDI QIDQ5944553
Aiichiro Nakano, Elefterios Lidorikis, Rajiv K. Kalia, Fuyuki Shimojo, Shuji Ogata, Priya Vashishta
Publication date: 10 October 2001
Published in: Computer Physics Communications (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/s0010-4655(01)00203-x
Density-functional theoryFinite-element methodHybrid simulationMolecular dynamicsParallel computation
Finite element methods applied to problems in solid mechanics (74S05) Parallel numerical computation (65Y05)
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