With the help of this principle, a theoretical explanation is presented for the real system (2) of the new subshell appearance, and its comparative analysis with the ideal system (1) of shell filling is performed. Moreover, in the process of the material presentation, the nature of the ...
aProposed OER catalytic mechanisms for BHZ-48.bCalculated energy barriers of the *OH transformation to *OOH at active sites of BHZ-48 and BHZ-96. Gibbs free-energy diagram forcOER of BHZ-48,dORR of ZnHZ, CoHZ, and BHZ-48 with corresponding top views of the structures. Blue, gray, whit...