Mn4CdO5 is Caswellsilverite-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn
Model training dataset for prediction of compressive strength and optimization of self-aware cementitious composites based on intrinsically interpretable models
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For
OsICl2(N2)2NO crystallizes in the tetragonal I4mm space group. The structure is two-dimensional and consists of eight ammonia molecules; two nitroxyl molecules; and two OsICl2 sheets oriented in the (
