Exploring the Polymorphism of Dicalcium Silicates Using Transfer Learning Enhanced Machine Learning Atomic Potentials

  1. López-Zorrilla, J.
  2. Aretxabaleta, X.M.
  3. Manzano, H.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Year of publication: 2024

Volume: 20

Issue: 17

Pages: 7682-7690

Type: Article

DOI: 10.1021/ACS.JCTC.4C00479 GOOGLE SCHOLAR