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Chemical shift
4
Density functional theory
Ammonia
2
Ammonia molecules
2
Chemical shielding
2
Computer simulation
2
Conformations
2
Density functional calculations
2
Density functional theory calculations
2
Derivatives
2
Deuterated liquids
2
Deuterium
2
Electronic polarization
2
Experimental values
2
Functional groups
2
Geometry relaxation
2
Hydrogen bonded molecules
2
Iterative procedures
2
Lennard-Jones potential
2
Liquid ammonia
2
Liquid chemicals
2
Liquids
2
Maleimide/phthalimide derivatives
2
Methoxy chemical shifts
2
Methoxy groups
2
Molecules
2
Monte Carlo Simulation
2
Monte Carlo methods
2
Nuclear magnetic resonance
2
Phthalimide derivatives
2
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2por Vitale, A.A., Stahl, A.E., Cecilia dos Santos Claro, P., Alejandra Floridia Addato, M., Pis Diez, R., Jubert, A.H.Materias: “...Methoxy chemical shifts...”
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3Publicado 2009Materias: “...Chemical shift...”
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4Materias: “...Chemical shift...”
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