Array ( [0] => Array ( [id] => 1767 [topology] => 4<sup>3</sup>T147-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3862] [space_group] => Pnna [pearson] => oP24 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T147-CA [sp_atoms] => [caid] => 572 [nn] => 0 [name] => [pressure] => [density] => 3.223 [e_gap] => [energy] => 0.321 [bulk_mod] => 388.5 [shear_mod] => 391.6 [vicker_hard] => 70.6 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1768 [topology] => 4<sup>3</sup>T147-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3862] [space_group] => Pnna [pearson] => oP24 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T147-CA [sp_atoms] => [caid] => 572 [nn] => 1 [name] => 4<sup>3</sup>T147-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: 572 Topology: 43T147-CA # of independent nodes (IN): 3 Transitivity: [3862] Space Group: Pnna Pearson: oP24 Coordination Number (CN): 4 Year: 2021 ![]() ![]() |
|
Name |
Pressure, GPa |
Density, g/cm³ |
Gap, eV |
Relative energy, eV/atom |
Bulk, GPa |
Shear, GPa |
Vickers, GPa |
Refs |
---|---|---|---|---|---|---|---|---|
43T147-CA (SACADA #572) | 3.223 | 0.321 | 388.5 | 391.6 | 70.6 | SACADA¹ | ||
43T147-CA | doi: 10.1038/s41524-021-00491-y ![]() |
8958.1848 | 795.2739 | 1792.8761 | -0.0000 | 0.0000 | -0.0000 |
795.2739 | 9091.2246 | 1196.7435 | -0.0000 | 0.0000 | -0.0000 |
1792.8761 | 1196.7435 | 9403.6535 | 0.0000 | 0.0000 | 0.0000 |
-0.0000 | -0.0000 | 0.0000 | 3810.9838 | -0.0000 | -0.0000 |
-0.0000 | 0.0000 | -0.0000 | -0.0000 | 4126.0919 | 0.0000 |
-0.0000 | -0.0000 | 0.0000 | -0.0000 | -0.0000 | 3787.4202 |