Array
(
[0] => Array
(
[id] => 1745
[topology] => 4<sup>3</sup>T58-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3774]
[space_group] => P21/n
[pearson] => mP12
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T58-CA
[sp_atoms] =>
[caid] => 561
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.272
[e_gap] =>
[energy] => 0.988
[bulk_mod] => 357.9
[shear_mod] => 341.8
[vicker_hard] => 59.5
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1746
[topology] => 4<sup>3</sup>T58-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3774]
[space_group] => P21/n
[pearson] => mP12
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T58-CA
[sp_atoms] =>
[caid] => 561
[nn] => 1
[name] => 4<sup>3</sup>T58-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: 561 Topology: 43T58-CA # of independent nodes (IN): 3 Transitivity: [3774] Space Group: P21/n Pearson: mP12 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 |
|---|---|---|---|---|---|---|---|---|
| 43T58-CA (SACADA #561) | 3.272 | 0.988 | 357.9 | 341.8 | 59.5 | SACADA¹ | ||
| 43T58-CA | doi: 10.1038/s41524-021-00491-y |
| 9183.5489 | 2156.4577 | 898.8409 | -0.0000 | 0.0000 | 219.6637 |
| 2156.4577 | 6577.7315 | 844.6137 | 0.0000 | -0.0000 | -661.8928 |
| 898.8409 | 844.6137 | 8956.0320 | 0.0000 | -0.0000 | 458.5390 |
| -0.0000 | 0.0000 | 0.0000 | 4068.3517 | -438.2960 | 0.0000 |
| 0.0000 | -0.0000 | -0.0000 | -438.2960 | 2723.4331 | 0.0000 |
| 219.6637 | -661.8928 | 458.5390 | 0.0000 | 0.0000 | 3691.9355 |