Array ( [0] => Array ( [id] => 1719 [topology] => 4<sup>3</sup>T22-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3763] [space_group] => P63/m [pearson] => hP28 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T22-CA [sp_atoms] => [caid] => 548 [nn] => 0 [name] => [pressure] => [density] => 3.385 [e_gap] => [energy] => 0.201 [bulk_mod] => 418.2 [shear_mod] => 440.6 [vicker_hard] => 81.0 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1720 [topology] => 4<sup>3</sup>T22-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3763] [space_group] => P63/m [pearson] => hP28 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T22-CA [sp_atoms] => [caid] => 548 [nn] => 1 [name] => 4<sup>3</sup>T22-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: 548 Topology: 43T22-CA # of independent nodes (IN): 3 Transitivity: [3763] Space Group: P63/m Pearson: hP28 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 |
---|---|---|---|---|---|---|---|---|
43T22-CA (SACADA #548) | 3.385 | 0.201 | 418.2 | 440.6 | 81.0 | SACADA¹ | ||
43T22-CA | doi: 10.1038/s41524-021-00491-y ![]() |
10925.2857 | 1072.8569 | 923.4265 | 0.7752 | -0.0614 | -0.2153 |
1072.8569 | 10917.9211 | 924.0371 | 0.7483 | -0.3244 | 0.1526 |
923.4265 | 924.0371 | 9998.0486 | 1.1317 | -1.1593 | 0.1751 |
0.7752 | 0.7483 | 1.1317 | 4925.6148 | 4.6836 | 0.1093 |
-0.0614 | -0.3244 | -1.1593 | 4.6836 | 3812.3164 | 2.0535 |
-0.2153 | 0.1526 | 0.1751 | 0.1093 | 2.0535 | 3815.3866 |