Use of FT-IR, FT-Raman and thermal analysis to evaluate the gel formation of curdlan produced by Agrobacterium sp. IFO 13140 and determination of its rheological properties with food applicability

2017 ◽  
Vol 232 ◽  
pp. 369-378 ◽  
Author(s):  
Camila Sampaio Mangolim ◽  
Thamara Thaiane da Silva ◽  
Vanderson Carvalho Fenelon ◽  
Adriane do Nascimento ◽  
Francielle Sato ◽  
...  
2010 ◽  
Vol 168-170 ◽  
pp. 518-522 ◽  
Author(s):  
Zhi Hua Ou ◽  
Bao Guo Ma ◽  
Shou Wei Jian

Fourier Transform Infrared Spectroscopy (FT-IR), thermal analysis and X-Ray Diffraction (XRD) are commonly performed to study the hydration products in cement pastes. The three methods were compared in this frame to detect products of cement hydration at different ages, especially at early ages (before 24h ages). The results indicate from the present experiment that CH (Calcium hydroxide) can be detected by three methods at all ages; C-S-H can be distinguished by FT-IR at all ages; ettringite may be detected by FT-IR before 24h ages and by XRD at all ages; and monosulphate can be detected by FT-IR before 24h ages. The process of cement hydration, characterized by formation and development of some hydration products, can be clearly observed by three methods. FT-IR is suggested for detecting the major hydration products before 24h ages, FT-IR and XRD are suggested for detecting the major hydration products after 24h ages, and thermal analysis is suggested for analyzing the degree of hydration quantitatively.


The Analyst ◽  
2004 ◽  
Vol 129 (10) ◽  
pp. 917-920 ◽  
Author(s):  
Hartwig Schulz ◽  
Malgorzata Baranska ◽  
Rolf Quilitzsch ◽  
Wolfgang Schütze

2015 ◽  
Vol 8 (3) ◽  
pp. 2197-2221
Author(s):  
Theraviyum Chithambarathanu ◽  
M. Darathi ◽  
J. DaisyMagdaline ◽  
S. Gunasekaran

The molecular vibrations of Trichloro isocyanuric acid (C3Cl3N3O3) and Trithio cyanuric acid (C3H3N3S3) have been investigated in polycrystalline sample at room temperature by Fourier Transform Infrared (FT-IR) and FT-Raman spectroscopies in the region 4000-450 cm-1 and 4000-50 cm-1 respectively, which provide a wealth of structural information about the molecules. The spectra are interpreted with the aid of normal co-ordinate analysis following full structure optimization and force field calculations based on density functional theory   (DFT) using standard B3LYP / 6-311++ G (d, p) basis set for investigating the structural and spectroscopic properties. The vibrational frequencies are calculated and the scaled values are compared with experimental FT-IR and FT-Raman spectra. The scaled theoretical wave numbers shows very good agreement with experimental ones. The complete vibrational assignments are performed on the basis of potential energy distribution (PED) of vibrational modes, calculated with scaled quantum (SQM) method. Stability of the molecule arising from hyper conjugative interactions, charge delocalization has been analyzed using natural bond orbital (NBO) analysis. The results show that change in electron density (ED) in σ* and π* anti-bonding orbitals and second order delocalization   energy (E2) confirm the occurrence of Intra molecular Charge Transfer (ICT) within the molecule. The thermodynamic properties like heat capacity, entropy, enthalpy and zero point energy have been calculated for the molecule. The frontier molecular orbitals have been visualized and the HOMO-LUMO energy gap has been calculated. The Molecular Electrostatic Potential (MEP) analysis reveals the sites for electrophilic attack and nucleophilic reactions in the molecule.


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