Array
(
[0] => Array
(
[id] => 2009
[topology] => 4<sup>4</sup>T66-CA
[link_rcsr] =>
[in_col] => 4
[transitivity] => [4961]
[space_group] => P3221
[pearson] => hP24
[cn] => 4
[Year] => 2023
[cn_sort] => 004-
[topology_str] => 4^4T66-CA
[sp_atoms] =>
[caid] => 693
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.482
[e_gap] =>
[energy] => 0.481
[bulk_mod] => 412.8
[shear_mod] => 457.7
[vicker_hard] => 85.5
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 2010
[topology] => 4<sup>4</sup>T66-CA
[link_rcsr] =>
[in_col] => 4
[transitivity] => [4961]
[space_group] => P3221
[pearson] => hP24
[cn] => 4
[Year] => 2023
[cn_sort] => 004-
[topology_str] => 4^4T66-CA
[sp_atoms] =>
[caid] => 693
[nn] => 1
[name] => 4<sup>4</sup>T66-CA
[pressure] =>
[density] =>
[e_gap] =>
[energy] =>
[bulk_mod] =>
[shear_mod] =>
[vicker_hard] =>
[ref_file] => /References/2023_ActaCrystB_79
[publ_year] => 2023
[ref] => doi: <a href="http://doi.org/10.1107/S205252062300255X" target="_blank">10.1107/S205252062300255X</a>
)
)
|
SACADA Database Code: 693 Topology: 44T66-CA # of independent nodes (IN): 4 Transitivity: [4961] Space Group: P3221 Pearson: hP24 Coordination Number (CN): 4 Year: 2023 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 |
|---|---|---|---|---|---|---|---|---|
| 44T66-CA (SACADA #693) | 3.482 | 0.481 | 412.8 | 457.7 | 85.5 | SACADA¹ | ||
| 44T66-CA | doi: 10.1107/S205252062300255X |
| 11379.7877 | 1045.8074 | 867.2223 | 1.8444 | -238.4639 | -0.0177 |
| 1045.8074 | 11374.2945 | 878.2223 | -1.3984 | 237.8885 | 1.0959 |
| 867.2223 | 878.2223 | 9045.1764 | 9.4708 | 2.2786 | 1.3884 |
| 1.8444 | -1.3984 | 9.4708 | 5176.8768 | 4.4595 | -241.0764 |
| -238.4639 | 237.8885 | 2.2786 | 4.4595 | 4108.3688 | 4.1346 |
| -0.0177 | 1.0959 | 1.3884 | -241.0764 | 4.1346 | 4107.3517 |