surface_name site_name species_name formation_energy bulk_structure frequencies other_parameters reference None gas H2O 0.0 None [3950.66147227,3834.50307382,1570.73801788] [] gas phase calcs None gas H2 0.0 None [4424.26845539] [] gas phase calcs None gas H2e 0.0 None [4424.26845539] [] gas phase calcs None gas H 0.0 None [] [] gas phase calcs Pt 111 H -0.34 fcc [1041.56374618,895.13059802,651.876743135] [] my ads calcs Pt 111 H-ele 0.3 fcc [] [] my ads calcs Pt 111 H-H 0.19 fcc [] [] CatApp