The Adsorption and Diffusion Manners of Hydrogen Atoms on Pt (100), Pt (110), and Pt (111) Surfaces

Table 3

Comparison of the results of this study with previous studies.

Systems	Sites	z (Å)	Theoretical; Results; z (Å)	E (eV)	Experimental; Results; (eV)	Theoretical; Results; (eV)
H – Pt(100)	T	1.55	1.64 [14]	-2.283		1.880 [14]
	H	0.55	0.70 [14]	-2.832	-2.565 [7]	-2.340 [14], -2.28 [28]
	B	1.15	1.76 [12], 1.07 [14]	-2.524		-2.91 [12], -2.31 [14]
H – Pt(110)	T	1.6	1.62 [14]	-2.178		-1.69 [14]
	H	0.4	0.39 [14]	-2.734		-2.28 [14]
	SB	1	1.03 [14]	-2.385		-2.22 [14]
	LB	0.2	0.10 [14]	-2.837		-2.33 [14]
H – Pt(111)	T	1.6	1.57 [13], 1.64 [14], 1.58 [25], 1.53 [26]	−2.312	-2.78 [5]	-2.75 [13], -2.61 [13], -2.00 [14], -2.65 [25], -2.76 [26],
	fcc-H	1.0	1.87 [12], 0.98 [25], 0.91 [26]	−2.647	-2.456 [7], -2.643 [7], -2.63 [7]	-2.72 [12], -2.74 [13], -2.57 [13], -2.55 [14], -2.55 [19], -2.64 [22], -2.58 [25], -2.49 [26]
	hcp-H	1.0	0.90 [26]	−2.641		-2.71 [13], -2.55 [13], -2.562 [14], -2.66 [26]
	B	1.2	1.13 [25], 1.05 [26]	−2.590		-2.476 [14], -2.58 [25], -2.68 [26],