Array
(
[0] => Array
(
[id] => 1723
[topology] => 4<sup>3</sup>T31-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3983]
[space_group] => Cmcm
[pearson] => oS40
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T31-CA
[sp_atoms] =>
[caid] => 550
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.395
[e_gap] =>
[energy] => 0.190
[bulk_mod] => 419.9
[shear_mod] => 446.5
[vicker_hard] => 82.4
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1724
[topology] => 4<sup>3</sup>T31-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3983]
[space_group] => Cmcm
[pearson] => oS40
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T31-CA
[sp_atoms] =>
[caid] => 550
[nn] => 1
[name] => 4<sup>3</sup>T31-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: 550 Topology: 43T31-CA # of independent nodes (IN): 3 Transitivity: [3983] Space Group: Cmcm Pearson: oS40 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 |
|---|---|---|---|---|---|---|---|---|
| 43T31-CA (SACADA #550) | 3.395 | 0.190 | 419.9 | 446.5 | 82.4 | SACADA¹ | ||
| 43T31-CA | doi: 10.1038/s41524-021-00491-y |
| 10432.5510 | 1147.3451 | 1124.0113 | 0.0000 | -0.0000 | 0.0000 |
| 1147.3451 | 11455.8969 | 651.0479 | 0.0000 | 0.0000 | -0.0000 |
| 1124.0113 | 651.0479 | 10101.6510 | -0.0000 | -0.0000 | -0.0000 |
| 0.0000 | 0.0000 | -0.0000 | 4989.2416 | 0.0000 | 0.0000 |
| -0.0000 | 0.0000 | -0.0000 | -0.0000 | 4321.7683 | -0.0000 |
| 0.0000 | -0.0000 | -0.0000 | 0.0000 | 0.0000 | 3528.5836 |