posted on 2015-09-15, 00:00authored byJinming Luo, Xubiao Luo, John Crittenden, Jiuhui Qu, Yaohui Bai, Yue Peng, Junhua Li
Zirconium oxide (ZrO2)-carbon nanofibers (ZCN) were
fabricated and batch experiments were used to determine antimonite
(Sb(III)) and antimonate (Sb(V)) adsorption isotherms and kinetics.
ZCN have a maximum Sb(III) and Sb(V) adsorption capacity of 70.83
and 57.17 mg/g, respectively. The adsorption process between ZCN and
Sb was identified to be an exothermic and follows an ion-exchange
reaction. The application of ZCN was demonstrated using tap water
spiked with Sb (200 μg/L). We found that the concentration of
Sb was well below the maximum contaminant level for drinking water
with ZCN dosages of 2 g/L. X-ray photoelectron spectroscopy (XPS)
revealed that an ionic bond of Zr–O was formed with Sb(III)
and Sb(V). Based on the density functional theory (DFT) calculations,
Sb(III) formed Sb–O and O–Zr bonds on the surface of
the tetragonal ZrO2 (t-ZrO2) (111) plane and
monoclinic ZrO2 planes (m-ZrO2) (111) plane
when it adsorbs. Only an O–Zr bond was formed on the surface
of t-ZrO2 (111) plane and m-ZrO2 (111) plane
for Sb(V) adsorption. The adsorption energy (Ead) of Sb(III) and Sb(V) onto t-ZrO2 (111) plane
were 1.13 and 6.07 eV, which were higher than that of m-ZrO2 (0.76 and 3.35 eV, respectively).