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Advances in structure prediction of inorganic compounds | Armel Le Bail
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1 Jun 2006 | Journal: | 2nd Algerian Crystallography Congress, Alg’{e}rie (2005) | Subject: | Materials Science | Abstract: | There is a huge and confusing literature about inorganic crystal structure prediction. The word "prediction" is used sometimes as meaning "structure determination" since the process described needs the knowledge of the chemical composition and of the cell parameters. Some clarifications are presented here together with a new software (GRINSP) and some of its predictions. | Source: | arXiv, cond-mat/0606025 | Services: | Forum | Review | PDF | Favorites |
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