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Growth, Optical and Terahertz Characterization of Sodium Mesitylene Sulphonate (SMS) Crystal

Yamuna Murtunge1,*, S.B. Kulkarni2,** and S. S. Prabu3,***

1Department of Condensed Matter Physics and Material Science, Tata Institute of Fundamental Research, Mumbai 400005, India and Dr Homi Bhabha State University, Institute of Science, Mumbai-400032, India
2Dr Homi Bhabha State University, Institute of Science, Mumbai-400032, India
3Department of Condensed Matter Physics and Material Science, Tata Institute of Fundamental Research, Mumbai 400005, India

*yamuna.murtunge@tifr.res.in, **sbk_physics@yahoo.in, ***prabhu@tifr.res.in

We successfully grown the high-quality Sodium Mesitylene Sulfonate (SMS) single crystal using slow evaporation method at room temperature. The crystal has been analyzed using single crystal XRD and it belongs to the monoclinic structure with C2 space group suggesting data repeated after 180º rotation, the lattice parameters are a=8.6926 Å, b= 7.3679 Å, c=16.4519 Å and the angle α=γ=90º, β=103.79º. Functional groups and molecular analysis were identified using Fourier infrared and NMR spectroscopy. We report the optical properties using terahertz time-domain spectroscopy (THz TDS) in the range of 0.2-2.5THz. Electronic calculations were performed in the DFT framework in Vienna Ab initio Simulation Package (VASP).

Figure 1: Chemical reaction depicting formation of the crystal

Figure 2: (left) ORTEP 50%. (right) simulated (bottom) infrared spectrum shown with the measured one (top).

References
[1] Yin Li et al. “Growth and characterization of DSTMS crystals,” Journal of crystal growth 327(1), 127–132 (2011)
[2] J. Furthmüller, J. Hafner, and G. Kresse, “Dimer reconstruction and electronic surface states on clean and hydrogenated diamond (100) surfaces,” Physical Review B 53(11), 7334 (1996)

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