affiliation not provided to SSRN
DFT, Nano, Transition metals, O2 bond activation, N2 bond activation
DFT calculations, Ag13 cluster /SiO2 surface, Free energy profiles, Generation of ROS
OER, scaling relations
IR, Raman, AIMD, CaCO3, polymorphism, dft
DFT, Raman spectroscopy, nucleation, silica-based materials