Gas molecules (CO, NH${}_3$, CO${}_2$) sensing with Polyaniline Emardline salt (PANI ES) : a turbo TDDFT study

N. Hadian Jazi, I. Abdolhosseini Sarsari, N. Zare Dehnavi

The adsorption of gas molecules (CO, NH${}_3$, CO${}_2$ ) on Polyaniline Emeraldine salt has been performed to study gas sensing. Density functional theory (DFT) and time dependent den…