Abstract
Single crystal of Sulphamic acid Lithium chloride (SALC), the inorganic nonlinear optical material was synthesized by slow solvent evaporation technique. PXRD analysis confirmed the grown crystal belong to orthorhombic structure to space group of Pbca. The vibrationally assigned frequencies of FTIR were obtained experimentally and compared with theoretical assigned values were calculated by DFT/B3LYP with 6–311++G(d,p) basis set by Gaussian 09 W software. The Vickers micro hardness study led to the evaluation of crystal belongs to hard category. The calculated FMO energy values indicate the charge transfer occurs within the molecule. The hyperpolarizability values of the grown molecule have been computed.
Sign-in/Register to access full text options 
Free) 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a call
