Array
(
[0] => Array
(
[id] => 1715
[topology] => 4<sup>2</sup>T168
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2684]
[space_group] => C2/m
[pearson] => mS16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T168
[sp_atoms] =>
[caid] => 546
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.229
[e_gap] =>
[energy] => 0.346
[bulk_mod] => 382.5
[shear_mod] => 364.5
[vicker_hard] => 63.4
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1716
[topology] => 4<sup>2</sup>T168
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2684]
[space_group] => C2/m
[pearson] => mS16
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^2T168
[sp_atoms] =>
[caid] => 546
[nn] => 1
[name] => 4<sup>2</sup>T168
[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: 546 Topology: 42T168 # of independent nodes (IN): 2 Transitivity: [2684] Space Group: C2/m Pearson: mS16 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 |
|---|---|---|---|---|---|---|---|---|
| 42T168 (SACADA #546) | 3.229 | 0.346 | 382.5 | 364.5 | 63.4 | SACADA¹ | ||
| 42T168 | doi: 10.1038/s41524-021-00491-y |
| 9277.8671 | 1860.9638 | 1087.1734 | -0.0000 | -0.0000 | 271.8509 |
| 1860.9638 | 6890.8966 | 1271.6077 | -0.0000 | -0.0000 | -57.5173 |
| 1087.1734 | 1271.6077 | 10103.4685 | 0.0000 | 0.0000 | 465.3965 |
| 0.0000 | -0.0000 | 0.0000 | 3310.6937 | 512.6407 | 0.0000 |
| 0.0000 | -0.0000 | 0.0000 | 512.6407 | 3322.6381 | 0.0000 |
| 271.8509 | -57.5173 | 465.3965 | 0.0000 | 0.0000 | 4525.1924 |