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density functional theory
article
2
atomic contributions
2
chirality
2
dimethyl peroxide
2
hydrogen peroxide
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methyl hydroperoxide
2
optical rotatory power
2
Atomic cluster structure
1
Atoms
1
Canonical transformation
1
Chirality
1
Density functional theory
1
Dipole moment
1
Electric properties
1
Exchange-correlation functionals
1
Functional groups
1
Genetic algorithms
1
Hydrogen peroxide
1
Linear response functions
1
Methyl hydroperoxide
1
Molecules
1
Optical rotatory power
1
Oxidation
1
Peroxides
1
Stereochemistry
1
Time dependent density functional theory
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Time-dependent perturbation theory
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aromatic compound
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atomic particle
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1por Oña, Ofelia Beatriz, Bazterra, Víctor Eduardo, Caputo, María Cristina, Ferraro, Marta Beatriz, Facelli, Julio César
Publicado 2004 -
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