DOI: 10.1039/d6cp01194b ISSN: 1463-9076
A systematic study of Prussian blue analogs as cathode materials for calcium ion batteries and interstitial water regulation: first-principles calculations
Ying Jiang, Weiqi Song, Yue Zhao, Hongye Zhang, Feihu Zou, Yize Niu, Qiang Li, Yuanyuan PanThe insertion of interstitial water may alleviate the volume changes and increase the average voltage of Ca x MFe(CN) 6 · n H 2 O (M = Mn, Fe, and Co; 0 ≤ x ≤ 1; n = 0 and 2).