Discovery of Cellulose Surface Layer Conformation by Nonlinear Vibrational Spectroscopy

Zhang, Libing; Fu, Li; Wang, Hong-fei; Yang, Bin

doi:10.1038/srep44319

Discovery of Cellulose Surface Layer Conformation by Nonlinear Vibrational Spectroscopy

Journal Article · Tue Mar 14 00:00:00 EDT 2017 · Scientific Reports

DOI:https://doi.org/10.1038/srep44319· OSTI ID:1356504

Zhang, Libing ^[1]; Fu, Li ^[2]; Wang, Hong-fei ^[3]; Yang, Bin ^[1]

Washington State Univ., Pullman, WA (United States)
Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Fudan Univ., Shanghai (China)

Significant questions remain with respect to the structure and polymorphs of cellulose. These include the cellulose surface layers and the bulk crystalline core as well as the conformational differences. The Total Internal Reflection Sum Frequency Generation Vibrational Spectroscopy (TIR-SFG-VS) combined with the conventional SFG-VS (non-TIR) can help to resolve these questions by selectively characterizing the molecular structures of surface layers and the crystalline core of cellulose. From the SFG spectra in the C-H and O-H regions, we found that the surface layers of Avicel are essentially amorphous; while the surface layers of Iβ cellulose are crystalline but with different structural and spectroscopic signatures than that of its crystalline core. This work demonstrates the capacity of TIR and Non-TIR SFG-VS tools in selectively studying the structures and polymorphs of cellulose. In addition, these results also suggest that the assignments of major vibrational peaks for cellulose need to be further determined.

View Accepted Manuscript (DOE)

Research Organization:: Pacific Northwest National Laboratory (PNNL), Richland, WA (United States)

Sponsoring Organization:: USDOE

Grant/Contract Number:: AC05-76RL01830

OSTI ID:: 1356504

Report Number(s):: PNNL-SA--120731; KP1704020

Journal Information:: Scientific Reports, Journal Name: Scientific Reports Vol. 7; ISSN 2045-2322

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

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