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Method development pitfalls encountered

In this chapter, we survey recently developed algorithms for predicting low energy crystal packings and discuss speed, accuracy, and other aspects of the computational methods involved. We mention the pitfalls encountered in the predictions of crystal structures, and illustrate how experimental information can help speed up the process of generating and identifying the correct structure from a large set of possibilities. [Pg.329]


See other pages where Method development pitfalls encountered is mentioned: [Pg.30]    [Pg.5]    [Pg.124]    [Pg.270]    [Pg.10]    [Pg.223]    [Pg.461]    [Pg.45]    [Pg.418]   
See also in sourсe #XX -- [ Pg.124 ]




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Encounter

Method development

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