Ground and excited states of zinc phthalocyanine, zinc tetrabenzoporphyrin, and azaporphyrin analogs using DFT and TDDFT with Franck-Condon analysis

Physics & Astronomy

• zinc 50%
• analogs 45%
• density functional theory 43%
• ground state 37%
• excitation 27%
• molecules 10%
• tetrahydrofuran 5%
• porphyrins 5%
• symmetry 4%
• illuminating 3%
• spectrum analysis 3%
• broken symmetry 3%
• vapor phases 3%
• electronic structure 3%
• synthesis 2%
• vibration 2%
• vacuum 2%
• energy 2%
• characterization 2%
• spectroscopy 2%

Chemical Compounds

• Zinc Phthalocyanine 75%
• Excited State 45%
• Ground State 44%
• Density Functional Theory 35%
• Molecule 10%
• Point Group C4v 9%
• Point Group D4h 8%
• Energy 5%
• Porphyrin 5%
• Vacuum 5%
• Electronic State 4%
• Spectroscopy 4%
• UV/VIS Spectroscopy 3%
• Amount 2%

Medicine & Life Sciences

• Zn(II)-phthalocyanine 100%
• Zinc 54%
• zinc hematoporphyrin 13%
• tetrahydrofuran 10%
• Vacuum 7%
• Vibration 6%
• Spectrum Analysis 6%
• Gases 5%
• Theoretical Models 5%