most citedGeometrically-frustrated interactions drive structural complexity in amorphous calcium carbonate

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physics.chem-ph2023★ 1 cited

Coarse-grained versus fully atomistic machine learning for zeolitic imidazolate frameworks

Zoé Faure Beaulieu, Thomas C. Nicholas, John L. A. Gardner +2

Zeolitic imidazolate frameworks are widely thought of as being analogous to inorganic AB phases. We test the validity of this assumption by comparing simplified and fully ato…