Lakhani, K.; Kansara, S.; Gupta, S. K.; Sonvane, Y.; Seifu, D.; Gajjar, P. N.; Ahuja, R.
(2021-10-25)
In this present work, the investigation was carried out using density functional theory (DFT) for the dissociation
of noxious gas molecules such as carbon and nitrogen-based molecules (CO, CO2, N2, NH3, NO, and NO2) on ...