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• W2012080280 abstract "A simple potential representing the aluminosilicate framework with a simplified general valence force field and the cation-framework and cation-cation interactions with the help of changes, polarizabilities, and diamagnetic susceptibilities is used in a molecular dynamics study of the infrared and Raman spectra of cation-exchanged zeolite A with Si/Al ratio of 1. The results are compared to experimental Raman spectra of a series of dehydrated samples. The influence of the cations is evident up to 500 cm−1. Couplings of cation and framework motions are observed, as well as couplings of cations in different sites." @default.
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• W2012080280 date "1994-02-01" @default.
• W2012080280 modified "2023-09-25" @default.
• W2012080280 title "Vibrational spectra of cation-exchanged zeolite A. Experimental and molecular dynamics study" @default.
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• W2012080280 doi "https://doi.org/10.1016/0301-0104(94)87020-9" @default.
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