Array
(
[0] => Array
(
[id] => 1677
[topology] => 4<sup>2</sup>T17-CA
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2531]
[space_group] => Pbcn
[pearson] => oP16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T17-CA
[sp_atoms] =>
[caid] => 527
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.187
[e_gap] =>
[energy] => 0.343
[bulk_mod] => 386.0
[shear_mod] => 354.0
[vicker_hard] => 59.6
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1678
[topology] => 4<sup>2</sup>T17-CA
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2531]
[space_group] => Pbcn
[pearson] => oP16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T17-CA
[sp_atoms] =>
[caid] => 527
[nn] => 1
[name] => 4<sup>2</sup>T17-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: 527 Topology: 42T17-CA # of independent nodes (IN): 2 Transitivity: [2531] Space Group: Pbcn Pearson: oP16 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 |
|---|---|---|---|---|---|---|---|---|
| 42T17-CA (SACADA #527) | 3.187 | 0.343 | 386.0 | 354.0 | 59.6 | SACADA¹ | ||
| 42T17-CA | doi: 10.1038/s41524-021-00491-y |
| 8358.9735 | 1312.0424 | 1505.5331 | -0.0000 | 0.0000 | -0.0000 |
| 1312.0424 | 10032.0530 | 835.7969 | 0.0000 | 0.0000 | -0.0000 |
| 1505.5331 | 835.7969 | 9068.8748 | 0.0000 | 0.0000 | -0.0000 |
| -0.0000 | -0.0000 | 0.0000 | 4557.1964 | -0.0000 | -0.0000 |
| 0.0000 | 0.0000 | 0.0000 | -0.0000 | 3053.6536 | 0.0000 |
| -0.0000 | -0.0000 | -0.0000 | -0.0000 | -0.0000 | 2572.2351 |