Array
(
[0] => Array
(
[id] => 1771
[topology] => 4<sup>3</sup>T149-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(10)5]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T149-CA
[sp_atoms] =>
[caid] => 574
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.246
[e_gap] =>
[energy] => 0.287
[bulk_mod] => 390.0
[shear_mod] => 379.9
[vicker_hard] => 67.1
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1772
[topology] => 4<sup>3</sup>T149-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(10)5]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T149-CA
[sp_atoms] =>
[caid] => 574
[nn] => 1
[name] => 4<sup>3</sup>T149-CA
[pressure] =>
[density] =>
[e_gap] =>
[energy] =>
[bulk_mod] =>
[shear_mod] =>
[vicker_hard] =>
[ref_file] => /References/2021_npjComputMater_7_15
[publ_year] => 2021
[ref] => doi: <a href="http://doi.org/10.1038/s41524-021-00491-y" target="_blank">10.1038/s41524-021-00491-y</a>
)
)
|
SACADA Database Code: 574 Topology: 43T149-CA # of independent nodes (IN): 3 Transitivity: [39(10)5] Space Group: I2/m Pearson: mS24 Coordination Number (CN): 4 Year: 2021 Download CIF File Download PDF report |
|
Name |
Pressure, GPa |
Density, g/cm³ |
Gap, eV |
Relative energy, eV/atom |
Bulk, GPa |
Shear, GPa |
Vickers, GPa |
Refs |
|---|---|---|---|---|---|---|---|---|
| 43T149-CA (SACADA #574) | 3.246 | 0.287 | 390.0 | 379.9 | 67.1 | SACADA¹ | ||
| 43T149-CA | doi: 10.1038/s41524-021-00491-y |
| 12004.0236 | 523.3074 | 770.9832 | -0.0000 | 0.0000 | -162.2944 |
| 523.3074 | 10177.3311 | 942.9098 | 0.0000 | 0.0000 | -135.5444 |
| 770.9832 | 942.9098 | 8674.0866 | -0.0000 | -0.0000 | 70.9359 |
| -0.0000 | 0.0000 | -0.0000 | 4226.1766 | -67.8130 | 0.0000 |
| 0.0000 | -0.0000 | -0.0000 | -67.8130 | 2769.2523 | 0.0000 |
| -162.2944 | -135.5444 | 70.9359 | 0.0000 | 0.0000 | 3029.4570 |