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Materials by design and the exciting role of quantum computation/simulation

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Publication:1860460
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DOI10.1016/S0377-0427(02)00519-8zbMath1011.82500MaRDI QIDQ1860460

Arthur J. Freeman

Publication date: 23 February 2003

Published in: Journal of Computational and Applied Mathematics (Search for Journal in Brave)


zbMATH Keywords

computational materials sciencequantum materials design


Mathematics Subject Classification ID

Research exposition (monographs, survey articles) pertaining to statistical mechanics (82-02)


Related Items

Learning bounds for quantum circuits in the agnostic setting, Multi-scale constitutive model and computational framework for the design of ultra-high strength, high toughness steels, A micromorphic model for the multiple scale failure of heterogeneous materials



Cites Work

  • Parallelization of the FLAPW method
  • The Boltzmann Equation in the Theory of Electrical Conduction in Metals
  • Damped Electron Waves in Crystals
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