Materias dentro de su búsqueda.
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article
4
nuclear magnetic resonance spectroscopy
4
Chemical shielding calculations
3
Genetic algorithms
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Algorithms
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Calculations
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Clustering algorithms
2
Density functional theory
2
Endohedral clusters
2
Energy calculation
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Global optimization
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Magnetic Resonance Spectroscopy
2
Models, Chemical
2
Modified genetic algorithms
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Molecular dynamics
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Nanotechnology research
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Nitrogen Isotopes
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Parallel genetic algorithms
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Silicon clusters
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calculation
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chemical model
2
crystal structure
2
molecular interaction
2
nitrogen
2
solid state
2
19 F NMR
1
2 fluorobenzoic acid
1
2-methoxy- and 2-vinyloxynaphthalenes
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4 fluorobenzoic acid
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Ab initio calculations
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1Materias: “...Calculations...”
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2Materias: “...Quantum-mechanical calculation...”
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3Materias: “...Ab initio calculations...”
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4por Alkorta, I., Claramunt, R.M., Elguero, J., Ferraro, M.B., Facelli, J.C., Provasi, P.F., Reviriego, F.Materias: “...DFT-D calculations...”
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5Materias: “...Energy calculation...”
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6Materias: “...Chemical shielding calculations...”
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7Materias: “...Chemical shielding calculations...”
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8Materias: “...Energy calculation...”
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9Materias: “...Chemical shielding calculations...”
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10Materias: “...Calculations...”
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