Array
(
[0] => Array
(
[id] => 1789
[topology] => 4<sup>3</sup>T159-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(10)6]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T159-CA
[sp_atoms] =>
[caid] => 583
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.321
[e_gap] =>
[energy] => 0.206
[bulk_mod] => 404.0
[shear_mod] => 432.5
[vicker_hard] => 80.0
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1790
[topology] => 4<sup>3</sup>T159-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(10)6]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T159-CA
[sp_atoms] =>
[caid] => 583
[nn] => 1
[name] => 4<sup>3</sup>T159-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: 583 Topology: 43T159-CA # of independent nodes (IN): 3 Transitivity: [39(10)6] 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 |
|---|---|---|---|---|---|---|---|---|
| 43T159-CA (SACADA #583) | 3.321 | 0.206 | 404.0 | 432.5 | 80.0 | SACADA¹ | ||
| 43T159-CA | doi: 10.1038/s41524-021-00491-y |
| 9279.6810 | 309.0659 | 1354.5212 | -0.0000 | -0.0000 | -432.6380 |
| 309.0659 | 11589.9241 | 476.4405 | -0.0000 | -0.0000 | -13.6335 |
| 1354.5212 | 476.4405 | 11358.3619 | -0.0000 | 0.0000 | 1084.7371 |
| -0.0000 | -0.0000 | 0.0000 | 3539.2981 | 121.4474 | 0.0000 |
| -0.0000 | 0.0000 | 0.0000 | 121.4474 | 4242.0074 | -0.0000 |
| -432.6380 | -13.6335 | 1084.7371 | 0.0000 | -0.0000 | 4072.3298 |