Abstract:A new kind of borate crystalline material Sr 3 (BO 3 ) 2 with a similar calcite type structure was designed and synthesized by solid state reaction method, moreover, the single crystal growth was attempted with traditional Czochralski pulling method. Crystal phase of Sr 3 (BO 3 ) 2 was investigated by using X-Ray powder diffraction (XRPD) at room temperature and found similar to Ca 3 (BO 3 ) 2 crystal with space group of R-3c. The phase stability was studied by means of thermogravimetric differential thermal analysis (TG/DTA) and high temperature XRPD up to 1350 • C, where an obvious endothermic peak was observed in DTA curve around 1250 • C, and weak splits of diffraction peaks were found at temperatures above 1250 • C, indicating the existence of structure transformation for Sr 3 (BO 3 ) 2 crystal. Raman properties were studied experimentally and theoretically by using density functional perturbation theory, though the strongest frequency shift of Sr 3 (BO 3 ) 2 crystal (900 cm −1 ) was comparable to that of Ca 3 (BO 3 ) 2 (927 cm −1 ), the line width of the strongest Raman peak obtained for Sr 3 (BO 3 ) 2 (5.72 cm −1 ) was much lower than Ca 3 (BO 3 ) 2 (7.01 cm −1 ), indicating a larger Raman gain for Sr 3 (BO 3 ) 2 crystal, which would be favorable for stimulated Raman scattering application.