Array
(
[0] => Array
(
[id] => 1675
[topology] => 4<sup>2</sup>T16-CA
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2552]
[space_group] => Pnma
[pearson] => oP16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T16-CA
[sp_atoms] =>
[caid] => 526
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.154
[e_gap] =>
[energy] => 0.396
[bulk_mod] => 371.5
[shear_mod] => 340.5
[vicker_hard] => 57.3
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1676
[topology] => 4<sup>2</sup>T16-CA
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2552]
[space_group] => Pnma
[pearson] => oP16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T16-CA
[sp_atoms] =>
[caid] => 526
[nn] => 1
[name] => 4<sup>2</sup>T16-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: 526 Topology: 42T16-CA # of independent nodes (IN): 2 Transitivity: [2552] Space Group: Pnma 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 |
|---|---|---|---|---|---|---|---|---|
| 42T16-CA (SACADA #526) | 3.154 | 0.396 | 371.5 | 340.5 | 57.3 | SACADA¹ | ||
| 42T16-CA | doi: 10.1038/s41524-021-00491-y |
| 9887.1828 | 439.6138 | 1177.9446 | -0.0000 | -0.0000 | 0.0000 |
| 439.6138 | 9635.8585 | 1464.2864 | 0.0000 | 0.0000 | 0.0000 |
| 1177.9446 | 1464.2864 | 7802.8201 | -0.0000 | -0.0000 | 0.0000 |
| -0.0000 | 0.0000 | -0.0000 | 3007.4039 | 0.0000 | 0.0000 |
| -0.0000 | 0.0000 | -0.0000 | 0.0000 | 2107.9471 | -0.0000 |
| 0.0000 | 0.0000 | -0.0000 | 0.0000 | -0.0000 | 4561.6714 |