First-Principles Simulation on Femtosecond Dynamics in Condensed Matters Within TDDFT-MD Approach

DOI10.1007/3-540-35074-8_5MaRDI QIDQ2937487zbMATH OpenOpenAlexFDO

Authors Yoshiyuki Miyamoto

Publication date 9 January 2015

Published in High Performance Computing on Vector Systems (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/3-540-35074-8_5

Mathematics Subject Classification ID

Computer aspects of numerical algorithms (65Y99) Computational methods for problems pertaining to quantum theory (81-08) Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05)

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• Femtosecond electron diffraction: an atomic perspective of condensed phase dynamics

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