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Iterative diagonalization in augmented plane wave based methods in electronic structure calculations.
Peter Blaha
Harald Hofstätter
Othmar Koch
R. Laskowski
K. Schwarz
Published in:
J. Comput. Phys. (2010)
Keyphrases
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preprocessing
multiscale
significant improvement
benchmark datasets
structural information
qualitative and quantitative
information retrieval
image processing
hidden markov models
empirical studies
machine learning methods
complex structures