LiFe2(BO3)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a 4-coordinate geometry t
BeWFe2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two BeWFe2 ribbons oriented in the (1, 0, 0) direction. Be is bonded in a linear geometry to
CIF and XYZ data for R-CRYSTALS10 dataset including Ag, Au, CH_3NH_3PbI_3, Fe_2O_3, MoS_2, PbS, SnO_2, SrTiO_3, TiO_2, ZnOhttps://github.com/KurbanIntelligenceLab/R-CRYSTALS
This dataset contains data relates to the publication "Molecular-scale insights into the electrical double layer at oxide-electrolyte interfaces", by Zhang et al., 2024. In this work, we employ ab ini
