19657 4 80020 document 19657 Fig13_model_vs_expt_and_DFT_no_P2_v2.agr text/plain b32288495da352a7c9ed06707709a2ce MD5 91557 2025-11-09 14:49:48 https://researchdata.bath.ac.uk/1590/28/Fig13_model_vs_expt_and_DFT_no_P2_v2.agr 1590 28 7 text/plain other Figure 13 shows the the oxygen atom speciation, as expressed by the fractions f_{O(II)}, f_{O(III)}, f_{PO(II)P}, f_{PO(II)Ti}, f_{TiO(II)Ti}, f_{PO(III)2Ti} and f_{TiO(III)2Ti}, found from (a) the analytical model and (b) the AIMD simulations. en public cc_by

Fig13_model_vs_expt_and_DFT_no_P2_v2.agr

data