Vitale V, Pizzi G, Marrazzo A, Yates JR, Marzari N, Mostofi AA2020Journal article Journal:npj Computational MaterialsVolume:6Issue:1, Springer Nature, p.66No abstract availableKeywords:3403 Macromolecular and Materials Chemistry , 34 Chemical Sciences , Bioengineering DOI10.1038/s41524-020-0312-y