Array ( [0] => Array ( [id] => 1813 [topology] => 4<sup>3</sup>T171-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3(10)94] [space_group] => P42/nmc [pearson] => tP48 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T171-CA [sp_atoms] => [caid] => 595 [nn] => 0 [name] => [pressure] => [density] => 2.734 [e_gap] => [energy] => 1.038 [bulk_mod] => 230.9 [shear_mod] => 151.6 [vicker_hard] => 17.2 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1814 [topology] => 4<sup>3</sup>T171-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3(10)94] [space_group] => P42/nmc [pearson] => tP48 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T171-CA [sp_atoms] => [caid] => 595 [nn] => 1 [name] => 4<sup>3</sup>T171-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: 595 Topology: 43T171-CA # of independent nodes (IN): 3 Transitivity: [3(10)94] Space Group: P42/nmc Pearson: tP48 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 |
---|---|---|---|---|---|---|---|---|
43T171-CA (SACADA #595) | 2.734 | 1.038 | 230.9 | 151.6 | 17.2 | SACADA¹ | ||
43T171-CA | doi: 10.1038/s41524-021-00491-y ![]() |
3700.9371 | 736.4340 | 1491.3557 | 0.0000 | -0.0000 | 0.0000 |
736.4340 | 3700.9371 | 1491.3557 | 0.0000 | -0.0000 | 0.0000 |
1491.3557 | 1491.3557 | 7469.9289 | 0.0000 | -0.0000 | 0.0000 |
0.0000 | 0.0000 | 0.0000 | 1144.5546 | -0.0000 | -0.0000 |
-0.0000 | 0.0000 | -0.0000 | -0.0000 | 1484.0585 | -0.0000 |
0.0000 | 0.0000 | 0.0000 | -0.0000 | -0.0000 | 1484.0585 |