New potentials for accurate and efficient ab initio crystal structure prediction methods

Authors :: Claire S. Adjiman
Constantinos C. Pantelides
David H. Bowskill
Christina-Anna Gatsiou
Isaac J. Sugden
Source :: Acta Crystallographica Section A Foundations and Advances. 74:e363-e363
Publication Year :: 2018
Publisher :: International Union of Crystallography (IUCr), 2018.

Subjects :: Inorganic Chemistry
Materials science
Structural Biology
Ab initio
General Materials Science
Physical and Theoretical Chemistry
Condensed Matter Physics
Biochemistry
Molecular physics
Crystal structure prediction

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