Nickel(II) complexes of whole set of the simple ethylenediaminetetracarboxylate ligands: DFT study of complexes invoking molecular orbital and configurational analysis

Engineering & Materials Science

• Molecular orbitals 100%
• Ligands 78%
• Discrete Fourier transforms 64%
• Nickel 54%
• Electronic properties 45%
• Absorption spectra 42%
• Charge transfer 37%
• Geometry 35%
• Structural properties 31%
• Atoms 30%
• Spectrum analysis 30%
• Nitrogen 27%
• Decomposition 21%
• Metals 18%

Physics & Astronomy

• ligands 59%
• molecular orbitals 58%
• nickel 47%
• carboxylates 40%
• nitrogen atoms 34%
• geometry 32%
• spectrum analysis 28%
• charge transfer 25%
• decomposition 22%
• absorption spectra 21%
• deviation 20%
• rings 20%
• energy 17%
• electronics 15%
• metals 14%

Chemistry

• Molecular Orbital 53%
• Density Functional Theory 36%
• Energy 27%
• Ligand 25%
• Electronic Property 24%
• Charge Transfer 20%
• Decomposition 18%