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Title: Materials Data on Ta27S50 by Materials Project

Abstract

Ta27S50 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are twenty-seven inequivalent Ta+3.70+ sites. In the first Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the second Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.45–2.53 Å. In the third Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.50 Å. In the fourth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.54 Å. In the fifth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 13°. There are amore » spread of Ta–S bond distances ranging from 2.47–2.49 Å. In the sixth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the seventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted edge and face-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.51 Å. In the eighth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the ninth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the tenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 13°. There are two shorter (2.47 Å) and four longer (2.48 Å) Ta–S bond lengths. In the eleventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.54 Å. In the twelfth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 12°. There are a spread of Ta–S bond distances ranging from 2.46–2.49 Å. In the thirteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the fourteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the fifteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the sixteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 14–44°. There are a spread of Ta–S bond distances ranging from 2.45–2.52 Å. In the seventeenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted edge and face-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.51 Å. In the eighteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the nineteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.50 Å. In the twentieth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 13–45°. There are a spread of Ta–S bond distances ranging from 2.46–2.52 Å. In the twenty-first Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the twenty-second Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 14°. There are a spread of Ta–S bond distances ranging from 2.46–2.49 Å. In the twenty-third Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of corner, edge, and face-sharing TaS6 octahedra. There are a spread of Ta–S bond distances ranging from 2.38–2.62 Å. In the twenty-fourth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the twenty-fifth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 46°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the twenty-sixth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the twenty-seventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of corner, edge, and face-sharing TaS6 octahedra. There are a spread of Ta–S bond distances ranging from 2.38–2.60 Å. There are fifty inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the second S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fourth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the fifth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the sixth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the seventh S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eighth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the ninth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the tenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eleventh S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twelfth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the fourteenth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fifteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the sixteenth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the seventeenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eighteenth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the nineteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twentieth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-first S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-second S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the twenty-third S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the twenty-fourth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-fifth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-sixth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-seventh S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-eighth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-ninth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirtieth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-first S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-second S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-fourth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-fifth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-sixth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirty-seventh S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirty-eighth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-ninth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the fortieth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the forty-first S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-second S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the forty-third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the forty-fourth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-fifth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the forty-sixth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-seventh S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the forty-eighth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-ninth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fiftieth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms.« less

Publication Date:
Other Number(s):
mp-530018
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Ta27S50; S-Ta
OSTI Identifier:
1263189
DOI:
https://doi.org/10.17188/1263189

Citation Formats

The Materials Project. Materials Data on Ta27S50 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1263189.
The Materials Project. Materials Data on Ta27S50 by Materials Project. United States. doi:https://doi.org/10.17188/1263189
The Materials Project. 2020. "Materials Data on Ta27S50 by Materials Project". United States. doi:https://doi.org/10.17188/1263189. https://www.osti.gov/servlets/purl/1263189. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1263189,
title = {Materials Data on Ta27S50 by Materials Project},
author = {The Materials Project},
abstractNote = {Ta27S50 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are twenty-seven inequivalent Ta+3.70+ sites. In the first Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the second Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.45–2.53 Å. In the third Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.50 Å. In the fourth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.54 Å. In the fifth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 13°. There are a spread of Ta–S bond distances ranging from 2.47–2.49 Å. In the sixth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the seventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted edge and face-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.51 Å. In the eighth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the ninth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the tenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 13°. There are two shorter (2.47 Å) and four longer (2.48 Å) Ta–S bond lengths. In the eleventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.54 Å. In the twelfth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 12°. There are a spread of Ta–S bond distances ranging from 2.46–2.49 Å. In the thirteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the fourteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the fifteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.55 Å. In the sixteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 14–44°. There are a spread of Ta–S bond distances ranging from 2.45–2.52 Å. In the seventeenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted edge and face-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.46–2.51 Å. In the eighteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the nineteenth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.50 Å. In the twentieth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 13–45°. There are a spread of Ta–S bond distances ranging from 2.46–2.52 Å. In the twenty-first Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form distorted edge-sharing TaS6 pentagonal pyramids. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the twenty-second Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 14°. There are a spread of Ta–S bond distances ranging from 2.46–2.49 Å. In the twenty-third Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of corner, edge, and face-sharing TaS6 octahedra. There are a spread of Ta–S bond distances ranging from 2.38–2.62 Å. In the twenty-fourth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 44°. There are a spread of Ta–S bond distances ranging from 2.47–2.55 Å. In the twenty-fifth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 46°. There are a spread of Ta–S bond distances ranging from 2.46–2.53 Å. In the twenty-sixth Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of distorted corner and edge-sharing TaS6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Ta–S bond distances ranging from 2.46–2.54 Å. In the twenty-seventh Ta+3.70+ site, Ta+3.70+ is bonded to six S2- atoms to form a mixture of corner, edge, and face-sharing TaS6 octahedra. There are a spread of Ta–S bond distances ranging from 2.38–2.60 Å. There are fifty inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the second S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fourth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the fifth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the sixth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the seventh S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eighth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the ninth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the tenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eleventh S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twelfth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the fourteenth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fifteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the sixteenth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the seventeenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the eighteenth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the nineteenth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twentieth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-first S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-second S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the twenty-third S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the twenty-fourth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-fifth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the twenty-sixth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-seventh S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-eighth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the twenty-ninth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirtieth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-first S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-second S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-fourth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-fifth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the thirty-sixth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirty-seventh S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the thirty-eighth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the thirty-ninth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the fortieth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the forty-first S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-second S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms. In the forty-third S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the forty-fourth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-fifth S2- site, S2- is bonded to four Ta+3.70+ atoms to form distorted edge-sharing STa4 trigonal pyramids. In the forty-sixth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-seventh S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the forty-eighth S2- site, S2- is bonded in a 3-coordinate geometry to three Ta+3.70+ atoms. In the forty-ninth S2- site, S2- is bonded in a distorted T-shaped geometry to three Ta+3.70+ atoms. In the fiftieth S2- site, S2- is bonded in a distorted rectangular see-saw-like geometry to four Ta+3.70+ atoms.},
doi = {10.17188/1263189},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}