当前位置: X-MOL 学术J. Solid State Chem. › 论文详情
Our official English website, www.x-mol.net, welcomes your feedback! (Note: you will need to create a separate account there.)
Li0.75Mn1.50Fe1.75(PO4)3: First alluaudite-type iron phosphate containing only Li+ as alkaline ions
Journal of Solid State Chemistry ( IF 3.2 ) Pub Date : 2018-05-26 , DOI: 10.1016/j.jssc.2018.05.014
Khiem Trad , Aurore Castets , Alain Wattiaux , Claude Delmas , Mongi Ben Amara , Dany Carlier

A new iron phosphate Li0.75Mn1.50Fe1.75(PO4)3 has been prepared by the flux method and its structure was characterized from single crystal X-ray diffraction data. It crystallizes as an alluaudite type structure, characterized by the A(2)A(2)’A(1)A(1)’A(1)”M(1)M(2)2(PO4)3 general formula with a = 12.002(9) Å, b = 12.509(9) Å, c = 6.404(7) Å, β = 115.07(7)° in the monoclinic C2/c space group. The 3D framework consists of infinite chains of edge-sharing M(2)2O10 dimers and M(1)O6 octahedra connected by phosphate tetrahedra leading to two sets of hexagonal tunnels. The Li+ and Mn2+ ions partially occupy one of them, the other tunnel being empty. The Mössbauer spectroscopy confirmed the occurrence of only Fe3+ ions in octahedral environment. Electrochemical cycling tests in Li cells were performed using Li0.75MnII1.50FeIII1.75(PO4)3 powder as electrode material. Only a small amount of Li+ ions can be reversibility deintercalated/intercalated corresponding to a capacity as low as 30 mAh/g with a 3.2 V average voltage. Moreover, a strong polarization due to low electronic and ionic conductivities is observed. The presence of Mn2+ ions in the same tunnel as Li+ probably hinders a good Li+ ionic diffusion.



中文翻译:

Li 0.75 Mn 1.50 Fe 1.75(PO 43:第一种钙铝石型磷酸铁,仅含有Li +作为碱性离子

通过助熔剂法制备了一种新的磷酸铁Li 0.75 Mn 1.50 Fe 1.75(PO 43,并根据单晶X射线衍射数据对其结构进行了表征。它结晶为一种钙铝榴石型结构,其特征在于A(2)A(2)'A(1)A(1)'A(1)” M(1)M(2)2(PO 43通式 在单斜C 2 / c空间群中,a = 12.002(9)Å,b = 12.509(9)Å,c = 6.404(7)Å,β = 115.07(7)° 。3D框架由边缘共享M(2)2的无限链组成O 10二聚体和M(1)O 6八面体通过磷酸盐四面体连接,从而形成两组六角形通道。Li +和Mn 2+离子部分占据其中一个,另一条隧道为空。Mössbauer光谱证实八面体环境中仅存在Fe 3+离子。使用Li 0.75 Mn II 1.50 Fe III 1.75(PO 43粉末作为电极材料在Li电池中进行电化学循环测试。只有少量的Li +离子可反嵌/嵌入的离子对应于平均电压为3.2 V时低至30 mAh / g的容量。此外,观察到由于低的电子和离子电导率而引起的强极化。在与Li +相同的隧道中存在Mn 2+离子可能会阻碍良好的Li +离子扩散。

更新日期:2018-07-12
down
wechat
bug