Array
(
[0] => Array
(
[id] => 1799
[topology] => 4<sup>3</sup>T164-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3992]
[space_group] => C2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T164-CA
[sp_atoms] =>
[caid] => 588
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.046
[e_gap] =>
[energy] => 0.428
[bulk_mod] => 359.0
[shear_mod] => 293.8
[vicker_hard] => 42.8
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1800
[topology] => 4<sup>3</sup>T164-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3992]
[space_group] => C2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T164-CA
[sp_atoms] =>
[caid] => 588
[nn] => 1
[name] => 4<sup>3</sup>T164-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: 588 Topology: 43T164-CA # of independent nodes (IN): 3 Transitivity: [3992] Space Group: C2/m Pearson: mS24 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 |
|---|---|---|---|---|---|---|---|---|
| 43T164-CA (SACADA #588) | 3.046 | 0.428 | 359.0 | 293.8 | 42.8 | SACADA¹ | ||
| 43T164-CA | doi: 10.1038/s41524-021-00491-y |
| 8040.2885 | 2864.3501 | 772.0163 | -0.0000 | 0.0000 | -27.5218 |
| 2864.3501 | 4980.4914 | 1847.4855 | 0.0000 | 0.0000 | 283.1280 |
| 772.0163 | 1847.4855 | 8681.8206 | 0.0000 | 0.0000 | -159.4596 |
| -0.0000 | 0.0000 | 0.0000 | 3451.7281 | 139.8300 | 0.0000 |
| 0.0000 | 0.0000 | 0.0000 | 139.8300 | 2870.5261 | -0.0000 |
| -27.5218 | 283.1280 | -159.4596 | 0.0000 | 0.0000 | 3885.1816 |