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Molecular dynamics
Computational methods
2
Atomic cluster energies
1
Atoms
1
Carr Parinello molecular dynamics code
1
Computational complexity
1
Crystal structure
1
Density functional theory
1
Derivatives
1
Diamagnetism
1
Electric dipole
1
Electronic wave functions
1
Genetic algorithms
1
Global optimization
1
Hypermagnetizability
1
Magnetic anisotropy
1
Magnetic field effects
1
Magnetic shielding
1
Magnetic susceptibility
1
Molecular polarizabilities
1
Molecules
1
Natural frequencies
1
Nonlinear response
1
Nuclear magnetic resonance
1
Nuclear magnetic shielding
1
Perturbation techniques
1
Polarization
1
Probability density function
1
Quantum theory
1
Substitution reactions
1
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1por Oña, Ofelia Beatriz, Bazterra, Víctor Eduardo, Caputo, María Cristina, Ferraro, Marta Beatriz, Facelli, Julio César
Publicado 2005 -
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