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Crystal structure landscapes from combined vibrational spectroscopy and ab initio calculations: 4-(Dimethylamino)benzaldehyde

✍ Scribed by Paulo J.A. Ribeiro-Claro; Pedro D. Vaz; Mariela Nolasco


Book ID
108286053
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
567 KB
Volume
946
Category
Article
ISSN
0166-1280

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## Abstract Variations in the structure of d(GGGA)~5~ oligonucleotide in the presence of Li^+^, Na^+^, and K^+^ ions and its temperature stability were studied using electronic and vibrational circular dichroism, IR absorption, and ab initio calculations with the Becke 3‐Lee‐Yang‐Parr functional at