Simplifying inverse materials design problems for fixed lattices with alchemical chirality

Brute-force compute campaigns relying on demanding ab initio calculations routinely search for previously unknown materials in chemical compound space (CCS), the vast set of all conceivable stable combinations of elements and structural configurations. Here, we demonstrate that four-dimensional chir...

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Detalles Bibliográficos
Autores principales: von Rudorff, Guido Falk, von Lilienfeld, O. Anatole
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Association for the Advancement of Science 2021
Materias:
Research Articles
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8133750/
https://www.ncbi.nlm.nih.gov/pubmed/34138735
http://dx.doi.org/10.1126/sciadv.abf1173

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8133750/
https://www.ncbi.nlm.nih.gov/pubmed/34138735
http://dx.doi.org/10.1126/sciadv.abf1173

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