Environmental-sulfur-controlled surface properties of pyrite: a first principles PBE + U study
Haiyang Xian, Xiao Wu, Jianxi Zhu, Runxiang Du, Jingming Wei, Runliang Zhu, Hongping He
Topics & Concepts
PyriteChemistryStoichiometrySulfurDensity functional theoryChemical physicsComputational chemistryAtom (system on chip)Relaxation (psychology)Physical chemistryMineralogyOrganic chemistrySocial psychologyEmbedded systemComputer sciencePsychologyMetal Extraction and BioleachingMinerals Flotation and Separation TechniquesMine drainage and remediation techniques