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Ab initio and DFT study of the static dipole (hyper)polarizabilities of benzaldehyde and thio-benzaldehyde molecules in gas phase.
Humberto Soscún
Published in:
J. Comput. Methods Sci. Eng. (2010)
Keyphrases
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data structure
study proposes
real time
machine learning
objective function
information technology
multiresolution
frequency domain