- Article
Theoretical and Experimental Study of LiBH4-LiCl Solid Solution
- Olena Zavorotynska,
- Marta Corno,
- Eugenio Pinatel,
- Line H. Rude,
- Piero Ugliengo,
- Torben R. Jensen and
- Marcello Baricco
Anion substitution is at present one of the pathways to destabilize metal borohydrides for solid state hydrogen storage. In this work, a solid solution of LiBH4 and LiCl is studied by density functional theory (DFT) calculations, thermodynamic modeli...

