Computational design and molecular modeling of the interaction of nicotinic acid hydrazide nickel-based complexes with H<sub>2</sub>S gas
Hitler Louis, Daniel Etiese, Tomsmith O. Unimuke, Aniekan E. Owen, Abdullahi Ola Rajee, Terkumbur E. Gber, Chioma M. Chima, Ededet A. Eno, Emmanuel N. Nfor
Abstract
S gas sensor material. Thus, a profound assertion was given that the complex sensor surfaces exhibited very dense stability with regards to their relevant binding energies corresponding to various existing studies.
Topics & Concepts
ChemistryDensity functional theoryLigand (biochemistry)NickelHydrazideBond lengthDouble bondComputational chemistryPhysical chemistryCrystallographyOrganic chemistryReceptorBiochemistryCrystal structureGas Sensing Nanomaterials and SensorsNonlinear Optical Materials ResearchChemical Thermodynamics and Molecular Structure