HIGHLIGHTS
- who: (X=S et al. from the Université Paris Nord, Villetaneuse, France Nanjing University have published the research: Discovery of new boron-rich chalcogenides: orthorhombic B6X (X=S, Se), in the Journal: Scientific Reports Scientific Reports of 28/Nov/2019
- how: For boron and sulfur atoms the authors used all-electron basis sets which were optimized in earlier calculations4950.
SUMMARY
The computed enthalpies of the lowest-enthalpy structures as a function of pressure are shown in Fig 1c,d: B6S is stable in the Pmna structure at least in the 0 . . .
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