“…HOMO (green part) of (a-1) pristine g-C 3 N 4 and NM 1 @g-C3 N 4 , NM 1 ¼ (b-1) Ru 1 , (c-1) Rh 1 , (d-1) Pd 1 , (e-1) Ag 1 , (f-1) Os 1 , (g-1) Ir 1 , (h-1) Pt 1 , (i-1) Au 1 ; LUMO (purple part) of (a-2) pristine g-C 3 N 4 and NM 1 @g-C 3 N 4 , NM 1 ¼ (b-2) Ru 1 , (c-2) Rh 1 , (d-2) Pd 1 , (e-2) Ag 1 , (f-2) Os 1 , (g-2) Ir 1 , (h-2) Pt 1 , (i-2) Au 1 .The isovalue is set as 0.05 eÅ À3 . The balls in gray and blue represent the C and N atoms, repectively.…”