Solid-state sodium ion conductors are crucial for the next generation of all-solid-state sodium batteries with high capacity, low cost, and improved safety. Sodium closo-carbadodecaborate (NaCB H ) is an attractive Na-ion conductor owing to its high thermal, electrochemical, and interfacial stability. Mechanical milling has recently been shown to increase conductivity by five orders of magnitude at room temperature, making it appealing for application in all-solid-state sodium batteries.
View Article and Find Full Text PDFThe crystal structures of three thermal polymorphs (I, II, and III) for each isomer of -dicarbadodecaboranes CBH (, and ) have been determined by combining synchrotron radiation X-ray powder diffraction and density functional theory calculations. The structures are in agreement with previous calorimetric and spectroscopic studies. The difference between rotatory phases (plastic crystals) I and II lies in isotropic rotations in the former and anisotropic rotations of the icosahedral clusters in the latter.
View Article and Find Full Text PDFACS Appl Mater Interfaces
December 2021
The body-centered cubic (bcc) polymorph of NaCBH has been stabilized at room temperature by high-energy mechanical milling. Temperature-dependent electrochemical impedance spectroscopy shows an optimum at 45-min milling time, leading to an rt conductivity of 4 mS cm. Mechanical milling suppresses an order-disorder phase transition in the investigated temperature range.
View Article and Find Full Text PDFACS Appl Energy Mater
February 2021
LiBH has been widely studied as a solid-state electrolyte in Li-ion batteries working at 120 °C due to the low ionic conductivity at room temperature. In this work, by mixing with MgO, the Li-ion conductivity of LiBH has been improved. The optimum composition of the mixture is 53 v/v % of MgO, showing a Li-ion conductivity of 2.
View Article and Find Full Text PDFThe crystal structure of a mixed amide-imide phase, RbMgNDND, has been solved in the orthorhombic space group Pnma ( a = 9.55256(31), b = 3.70772(11) and c = 10.
View Article and Find Full Text PDFThree different types of anion packing, i.e., hexagonal close packed (hcp), cubic close packed (ccp), and body centered cubic (bcc), are investigated experimentally and with ab initio calculations in the model system NaBH.
View Article and Find Full Text PDF