Geometric and electronic structures of the synthetic Mn₄CaO₄ model compound mimicking the photosynthetic oxygen-evolving complex

Chemical Compounds

• Electron Spin 100%
• Spin State 90%
• Electronic State 88%
• Valence 70%
• Antiferromagnetic 38%
• Density Functional Theory 24%
• Modification 22%
• Energy 18%
• Ligand 17%

Physics & Astronomy

• electronic structure 89%
• oxygen 72%
• valence 21%
• chemical energy 20%
• water splitting 19%
• sustaining 18%
• electron states 16%
• ligands 15%
• retraining 14%
• alignment 11%
• density functional theory 11%
• oxidation 11%
• synthesis 10%
• water 8%
• atoms 7%
• interactions 5%