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Computational materials design of crystalline solids
The modelling of materials properties and processes from first principles is becoming sufficiently accurate as to facilitate the design and testing of new systems in silico. Computational materials science is both valuable and increasingly necessary for developing novel functional materials and comp...
Autores principales: | Butler, Keith T., Frost, Jarvist M., Skelton, Jonathan M., Svane, Katrine L., Walsh, Aron |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Royal Society of Chemistry
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5103860/ https://www.ncbi.nlm.nih.gov/pubmed/26992173 http://dx.doi.org/10.1039/c5cs00841g |
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