Array
(
[0] => Array
(
[id] => 1795
[topology] => 4<sup>3</sup>T162-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(11)5]
[space_group] => C2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T162-CA
[sp_atoms] =>
[caid] => 586
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.276
[e_gap] =>
[energy] => 0.304
[bulk_mod] => 394.1
[shear_mod] => 382.8
[vicker_hard] => 67.5
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1796
[topology] => 4<sup>3</sup>T162-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [39(11)5]
[space_group] => C2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T162-CA
[sp_atoms] =>
[caid] => 586
[nn] => 1
[name] => 4<sup>3</sup>T162-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: 586 Topology: 43T162-CA # of independent nodes (IN): 3 Transitivity: [39(11)5] 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 |
|---|---|---|---|---|---|---|---|---|
| 43T162-CA (SACADA #586) | 3.276 | 0.304 | 394.1 | 382.8 | 67.5 | SACADA¹ | ||
| 43T162-CA | doi: 10.1038/s41524-021-00491-y |
| 9465.6373 | 1741.7570 | 1102.7287 | -0.0000 | 0.0000 | -290.4270 |
| 1741.7570 | 7691.3994 | 1187.1308 | 0.0000 | 0.0000 | 199.6393 |
| 1102.7287 | 1187.1308 | 10429.7201 | 0.0000 | -0.0000 | -575.0492 |
| -0.0000 | 0.0000 | 0.0000 | 3333.1494 | -516.4743 | 0.0000 |
| 0.0000 | -0.0000 | -0.0000 | -516.4743 | 3524.3437 | -0.0000 |
| -290.4270 | 199.6393 | -575.0492 | 0.0000 | -0.0000 | 4660.3793 |