Materials Data on CsAgC2 by Materials Project
Abstract
CsAgC2 crystallizes in the tetragonal P4_2/mmc space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a distorted body-centered cubic geometry to eight C1- atoms. All Cs–C bond lengths are 3.54 Å. In the second Cs1+ site, Cs1+ is bonded in a distorted body-centered cubic geometry to eight C1- atoms. All Cs–C bond lengths are 3.54 Å. There are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a linear geometry to two C1- atoms. Both Ag–C bond lengths are 2.04 Å. In the second Ag1+ site, Ag1+ is bonded in a linear geometry to two C1- atoms. Both Ag–C bond lengths are 2.04 Å. There are four inequivalent C1- sites. In the first C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom. The C–C bond length is 1.25 Å. In the second C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom. The C–C bond length is 1.25 Å. In the third C1- site, C1- is bonded in a distorted linear geometry to four Cs1+,more »
- Authors:
- Publication Date:
- Other Number(s):
- mp-10101
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- 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)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; CsAgC2; Ag-C-Cs
- OSTI Identifier:
- 1186088
- DOI:
- https://doi.org/10.17188/1186088
Citation Formats
The Materials Project. Materials Data on CsAgC2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1186088.
The Materials Project. Materials Data on CsAgC2 by Materials Project. United States. doi:https://doi.org/10.17188/1186088
The Materials Project. 2020.
"Materials Data on CsAgC2 by Materials Project". United States. doi:https://doi.org/10.17188/1186088. https://www.osti.gov/servlets/purl/1186088. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1186088,
title = {Materials Data on CsAgC2 by Materials Project},
author = {The Materials Project},
abstractNote = {CsAgC2 crystallizes in the tetragonal P4_2/mmc space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a distorted body-centered cubic geometry to eight C1- atoms. All Cs–C bond lengths are 3.54 Å. In the second Cs1+ site, Cs1+ is bonded in a distorted body-centered cubic geometry to eight C1- atoms. All Cs–C bond lengths are 3.54 Å. There are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a linear geometry to two C1- atoms. Both Ag–C bond lengths are 2.04 Å. In the second Ag1+ site, Ag1+ is bonded in a linear geometry to two C1- atoms. Both Ag–C bond lengths are 2.04 Å. There are four inequivalent C1- sites. In the first C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom. The C–C bond length is 1.25 Å. In the second C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom. The C–C bond length is 1.25 Å. In the third C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom. In the fourth C1- site, C1- is bonded in a distorted linear geometry to four Cs1+, one Ag1+, and one C1- atom.},
doi = {10.17188/1186088},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 16 00:00:00 EDT 2020},
month = {Thu Jul 16 00:00:00 EDT 2020}
}