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Best Calculated: Crystal - PBE (Tight)
Animate Comparison
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Pack Atoms
Bonding Data
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Carbon Monoxide: Number of geometry optimisation steps
Carbon Monoxide: Binding energy
Carbon Monoxide: Longest intramolecular bond length
Carbon Monoxide: Shortest intramolecular bond length
Carbon Monoxide: Total number of SCF steps
Carbon Monoxide: Wallclock time
Carbon Monoxide: Final height of Carbon
Carbon Monoxide: Shortest interatomic distance between Carbon and any slab atom
Carbon Monoxide: Shortest interatomic distance between Oxygen and any slab atom
Carbon Monoxide: Average height of Oxygen relative to Carbon