Array
(
[0] => Array
(
[id] => 1977
[topology] => 4<sup>4</sup>T46-CA
[link_rcsr] =>
[in_col] => 4
[transitivity] => [4(10)61]
[space_group] => P3221
[pearson] => hP24
[cn] => 4
[Year] => 2023
[cn_sort] => 004-
[topology_str] => 4^4T46-CA
[sp_atoms] =>
[caid] => 677
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.283
[e_gap] =>
[energy] => 0.499
[bulk_mod] => 346.4
[shear_mod] => 376.8
[vicker_hard] => 70.0
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1978
[topology] => 4<sup>4</sup>T46-CA
[link_rcsr] =>
[in_col] => 4
[transitivity] => [4(10)61]
[space_group] => P3221
[pearson] => hP24
[cn] => 4
[Year] => 2023
[cn_sort] => 004-
[topology_str] => 4^4T46-CA
[sp_atoms] =>
[caid] => 677
[nn] => 1
[name] => 4<sup>4</sup>T46-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: 677 Topology: 44T46-CA # of independent nodes (IN): 4 Transitivity: [4(10)61] 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 |
|---|---|---|---|---|---|---|---|---|
| 44T46-CA (SACADA #677) | 3.283 | 0.499 | 346.4 | 376.8 | 70.0 | SACADA¹ | ||
| 44T46-CA | doi: 10.1107/S205252062300255X |
| 7802.1100 | 1011.2916 | 930.1596 | -0.0000 | 474.0768 | -0.0000 |
| 1011.2916 | 7802.1100 | 930.1596 | 0.0000 | -474.0768 | 0.0000 |
| 930.1596 | 930.1596 | 10010.0050 | 0.0000 | 0.0000 | -0.0000 |
| -0.0000 | 0.0000 | 0.0000 | 3395.4092 | -0.0000 | 474.0768 |
| 474.0768 | -474.0768 | 0.0000 | -0.0000 | 4044.4874 | 0.0000 |
| -0.0000 | 0.0000 | -0.0000 | 474.0768 | 0.0000 | 4044.4873 |