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Predicted structure and energetics of HCl2+

โœ Scribed by Marc Moix Teixidor; Fernando Pirani; Pietro Candori; Stefano Falcinelli; Franco Vecchiocattivi


Book ID
104108559
Publisher
Elsevier Science
Year
2003
Tongue
English
Weight
374 KB
Volume
379
Category
Article
ISSN
0009-2614

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Structural and energetic aspects of the
โœ M. Svรคrd; ร…. C. Rasmuson ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 486 KB

## Abstract In crystal structure prediction simulations based on lattice energy minimization, usually hundreds of structures within a reasonable range of lattice energy and density are found, whereas in practice, it is very rare to find more than a few polymorphs of the same compound. In the work p