Theoretical study on photophysical properties of angular-shaped mercury(II) bis(acetylide) complexes as light-emitting materials

Physics & Astronomy

• ligands 80%
• charge transfer 69%
• density functional theory 41%
• Commonwealth of Independent States 37%
• molecular absorption 37%
• ground state 35%
• molecules 28%
• configuration interaction 27%
• metals 27%
• excitation 25%
• transition metals 22%
• electronic structure 19%
• optical properties 17%
• geometry 15%
• electronics 13%
• atoms 13%

Chemical Compounds

• Acetylide 100%
• Charge Transfer 55%
• Ground State 42%
• Arylacetylene 40%
• Density Functional Theory 33%
• Excited Triplet State 30%
• Excited Singlet State 28%
• Optoelectronics 24%
• Electronic Property 22%
• Excited State 21%
• Electronic State 19%
• Optical Property 19%
• Transition Element 19%
• Molecule 18%