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Density functional theory
Gauge-including-atomic-orbitals
2
Nuclear magnetic resonance shielding
2
article
2
calculation
2
carbon
2
carbon 13
2
carbon nuclear magnetic resonance
2
chemical bond
2
chemical structure
density
2
geometry
2
hydrogen
nitrogen
2
proton nuclear magnetic resonance
2
structure analysis
2
theory
2
urea derivative
2
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1
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2