Array ( [0] => Array ( [id] => 1967 [topology] => 4<sup>4</sup>T3-CA [link_rcsr] => [in_col] => 4 [transitivity] => [4(10)84] [space_group] => P21/n [pearson] => mP16 [cn] => 4 [Year] => 2023 [cn_sort] => 004- [topology_str] => 4^4T3-CA [sp_atoms] => [caid] => 672 [nn] => 0 [name] => [pressure] => [density] => 3.496 [e_gap] => [energy] => 0.428 [bulk_mod] => 419.7 [shear_mod] => 476.0 [vicker_hard] => 89.4 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1968 [topology] => 4<sup>4</sup>T3-CA [link_rcsr] => [in_col] => 4 [transitivity] => [4(10)84] [space_group] => P21/n [pearson] => mP16 [cn] => 4 [Year] => 2023 [cn_sort] => 004- [topology_str] => 4^4T3-CA [sp_atoms] => [caid] => 672 [nn] => 1 [name] => 4<sup>4</sup>T3-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: 672 Topology: 44T3-CA # of independent nodes (IN): 4 Transitivity: [4(10)84] Space Group: P21/n Pearson: mP16 Coordination Number (CN): 4 Year: 2023 ![]() ![]() |
|
Name |
Pressure, GPa |
Density, g/cm³ |
Gap, eV |
Relative energy, eV/atom |
Bulk, GPa |
Shear, GPa |
Vickers, GPa |
Refs |
---|---|---|---|---|---|---|---|---|
44T3-CA (SACADA #672) | 3.496 | 0.428 | 419.7 | 476.0 | 89.4 | SACADA¹ | ||
44T3-CA | doi: 10.1107/S205252062300255X ![]() |
12433.2581 | 675.9836 | 455.9581 | -0.0000 | 0.0000 | -6.7143 |
675.9836 | 10748.8006 | 868.8497 | -0.0000 | 0.0000 | -210.1653 |
455.9581 | 868.8497 | 10647.7218 | -0.0000 | -0.0000 | 65.9190 |
-0.0000 | -0.0000 | -0.0000 | 5067.5754 | -32.7087 | -0.0000 |
0.0000 | 0.0000 | -0.0000 | -32.7087 | 3928.1045 | -0.0000 |
-6.7143 | -210.1653 | 65.9190 | -0.0000 | -0.0000 | 4393.9447 |