Insight into the elemental mercury immobilization mechanism with carbon and sulfur over the mackinawite (FeS) surface via density functional theory
Qixin Zhou, Jinsong Zhou, Lingtao Zhou, Chenghang Zheng, Zhuang Liu, Yang Lü, Bohao Li
Topics & Concepts
AdsorptionChemistryMackinawiteSulfurDensity functional theoryMercury (programming language)Inorganic chemistryEndothermic processAtom (system on chip)Physical chemistryComputational chemistrySulfideOrganic chemistryComputer scienceEmbedded systemProgramming languageMercury impact and mitigation studiesnanoparticles nucleation surface interactionsGas Sensing Nanomaterials and Sensors