Array
(
[0] => Array
(
[id] => 1779
[topology] => 4<sup>3</sup>T153-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3982]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T153-CA
[sp_atoms] =>
[caid] => 578
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.066
[e_gap] =>
[energy] => 0.585
[bulk_mod] => 310.3
[shear_mod] => 289.5
[vicker_hard] => 49.5
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1780
[topology] => 4<sup>3</sup>T153-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3982]
[space_group] => I2/m
[pearson] => mS24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T153-CA
[sp_atoms] =>
[caid] => 578
[nn] => 1
[name] => 4<sup>3</sup>T153-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: 578 Topology: 43T153-CA # of independent nodes (IN): 3 Transitivity: [3982] Space Group: I2/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 |
|---|---|---|---|---|---|---|---|---|
| 43T153-CA (SACADA #578) | 3.066 | 0.585 | 310.3 | 289.5 | 49.5 | SACADA¹ | ||
| 43T153-CA | doi: 10.1038/s41524-021-00491-y |
| 9240.8290 | 1032.2445 | 1485.3871 | -1.5435 | -0.8400 | 309.1641 |
| 1032.2445 | 4096.8261 | 1363.6326 | -2.5896 | 0.1742 | -155.4504 |
| 1485.3871 | 1363.6326 | 8772.0705 | 11.6308 | -1.3660 | 434.6114 |
| -1.5435 | -2.5896 | 11.6308 | 2452.3514 | 363.9654 | 0.6626 |
| -0.8400 | 0.1742 | -1.3660 | 363.9654 | 2686.1436 | 0.9022 |
| 309.1641 | -155.4504 | 434.6114 | 0.6626 | 0.9022 | 3873.8280 |