Materials Data on Tl3H by Materials Project

Kristin Persson
(Tl)6H2 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four dihydrogen molecules and one Tl framework. In the Tl framework, there are two inequivalent Tl sites. In the first Tl site, Tl is bonded to four equivalent Tl atoms to form a mixture of distorted edge and corner-sharing TlTl4 tetrahedra. All Tl–Tl bond lengths are 3.24 Å. In the second Tl site, Tl...
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