水热晶化法合成BaHPO_4单晶及结构研究

来源 :辽宁大学学报(自然科学版) | 被引量 : 0次 | 上传用户:shi123abc
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采用水热合成法成功地培养出一种新物相,BaHPO_4羊晶体。四圆x射线衍射结构测定证明,晶体属于正交晶系,空间群为Pbnm,晶胞参数a=0.4605(1),b=1.4175,(3),c=1.7186(9)nm,晶胞体积V=1.1219nm ̄3.晶体由HOPO_3基团和Ba原子构成,结构中含有HOPO_3基团构成的平行于(001)方向的链,多组链再形成两组不同取向的片层结构。晶体结构解析的最终偏离因子R=0.066:加权因子R_w=0.066。 A new phase, BaHPO_4 sheep crystal, was successfully produced by hydrothermal method. The results of tetragonal XRD showed that the crystal belongs to the orthorhombic system and the space group is Pbnm. The unit cell parameters a = 0.4605 (1), b = 1.4175, (3), c = 1.7186 ) Nm, cell volume V = 1.1219nm ~ 3. The crystal consists of HOPO_3 group and Ba atom. The structure contains HOPO_3 groups parallel to the (001) direction. Two groups of lamellar structures with different orientations are formed by multiple groups of chains. The final deviation factor of the crystal structure analysis is R = 0.066: the weighting factor R_w = 0.066.
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