“…The resulting defect sites, which can serve as the active sites for breaking chemical bonds, should enhance the catalytic activity [25,[51][52][53]. Indeed, we have previously observed that grain boundaries can facilitate H 2 activation/dissociation in partial hydrogenation reactions [31,54]. In addition, subsurface hydrogen, which is known to facilitate over hydrogenation, is more easily formed on Pd (1 0 0) than on Pd (1 1 1) [55][56][57][58][59].…”