Array
(
[0] => Array
(
[id] => 1719
[topology] => 4<sup>3</sup>T22-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3763]
[space_group] => P63/m
[pearson] => hP28
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T22-CA
[sp_atoms] =>
[caid] => 548
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.385
[e_gap] =>
[energy] => 0.201
[bulk_mod] => 418.2
[shear_mod] => 440.6
[vicker_hard] => 81.0
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1720
[topology] => 4<sup>3</sup>T22-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3763]
[space_group] => P63/m
[pearson] => hP28
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T22-CA
[sp_atoms] =>
[caid] => 548
[nn] => 1
[name] => 4<sup>3</sup>T22-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: 548 Topology: 43T22-CA # of independent nodes (IN): 3 Transitivity: [3763] Space Group: P63/m Pearson: hP28 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 |
|---|---|---|---|---|---|---|---|---|
| 43T22-CA (SACADA #548) | 3.385 | 0.201 | 418.2 | 440.6 | 81.0 | SACADA¹ | ||
| 43T22-CA | doi: 10.1038/s41524-021-00491-y |
| 10925.2857 | 1072.8569 | 923.4265 | 0.7752 | -0.0614 | -0.2153 |
| 1072.8569 | 10917.9211 | 924.0371 | 0.7483 | -0.3244 | 0.1526 |
| 923.4265 | 924.0371 | 9998.0486 | 1.1317 | -1.1593 | 0.1751 |
| 0.7752 | 0.7483 | 1.1317 | 4925.6148 | 4.6836 | 0.1093 |
| -0.0614 | -0.3244 | -1.1593 | 4.6836 | 3812.3164 | 2.0535 |
| -0.2153 | 0.1526 | 0.1751 | 0.1093 | 2.0535 | 3815.3866 |