https://www.selleckchem.com/pr....oducts/lithium-chlor
DFT and AIMD simulations support the observed trends. Overall, structures with cis ordering of the nitrogen anions in each TaO4N2 octahedron are favored over those with trans ordering. With diminishing A cation size, local cis ordering and Ta off-centering play decreasing roles in overall lattice stability, overshadowed by the stabilizing effects of octahedral tilting. The influence of these factors on local dipole formation and frustrated dipole ordering are discussed.Recently, the cytotoxic properties of galvanically coupled