Product Details of 1317-39-1, Name is Copper(I) oxide, belongs to copper-catalyst compound, is a common compound. Product Details of 1317-39-1In an article, authors is Bae, Gyun-Tack, once mentioned the new application about Product Details of 1317-39-1.
Density functional calculation of the structure and electronic properties of CunOn (n = 1-8) clusters
Ab initio simulations and calculations were used to study the structures and stabilities of copper oxide clusters, CunOn (n = 1-8). The lowest energy structures of neutral and charged copper oxide clusters were determined using primarily the B3LYP/LANL2DZ model chemistry. For n ? 4, the clusters are nonplanar. Selected electronic properties including atomization energies, ionization energies, electron affinities, and Bader charges were calculated and examined as a function of n.
Product Details of 1317-39-1, If you are hungry for even more, make sure to check my other article about Product Details of 1317-39-1
Reference£º
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”