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Figure 1 | Chemistry Central Journal

Figure 1

From: Quantum mechanical calculation of aqueuous uranium complexes: carbonate, phosphate, organic and biomolecular species

Figure 1

Calculated (a) IR and (b) Raman spectra in the 0 to 2000 cm-1 range of UO 2 (H 2 O) 6 •14(H 2 O) contain uranyl vibrational modes at frequencies consistent with observation, but the IR and Raman intensities of these predicted vibrations do not correspond with experiment. Model IR spectra of (c) UO2(CO3)34-•28(H2O) and (d) UO2(PO4)-(OH2)4•30(H2O) complexes exhibit reasonable correspondence to observed vibrational frequencies.

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BMC Chemistry

ISSN: 2661-801X

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