Materials Data on RbS by Materials Project

Dataset · Wed Jul 15 04:00:00 EDT 2020

DOI:https://doi.org/10.17188/1312943· OSTI ID:1312943

RbS is alpha boron-derived structured and crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six S1- atoms. There are four shorter (3.31 Å) and two longer (3.40 Å) Rb–S bond lengths. In the second Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six S1- atoms. There are two shorter (3.40 Å) and four longer (3.52 Å) Rb–S bond lengths. There are two inequivalent S1- sites. In the first S1- site, S1- is bonded to six Rb1+ and one S1- atom to form a mixture of distorted face, edge, and corner-sharing SRb6S pentagonal bipyramids. The S–S bond length is 2.13 Å. In the second S1- site, S1- is bonded to six Rb1+ and one S1- atom to form a mixture of distorted face, edge, and corner-sharing SRb6S pentagonal bipyramids. The S–S bond length is 2.14 Å.

• Research Organization: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
• Contributing Organization: The Materials Project; MIT; UC Berkeley; Duke; U Louvain
• DOE Contract Number: AC02-05CH11231
• OSTI ID: 1312943
• Report Number(s): mp-9062
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
Rb-S
RbS
crystal structure