Array ( [0] => Array ( [id] => 1825 [topology] => 4<sup>3</sup>T177-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3(10)(11)6] [space_group] => P-4m2 [pearson] => tP24 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T177-CA [sp_atoms] => [caid] => 601 [nn] => 0 [name] => [pressure] => [density] => 2.988 [e_gap] => [energy] => 0.578 [bulk_mod] => 336.2 [shear_mod] => 274.3 [vicker_hard] => 39.8 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1826 [topology] => 4<sup>3</sup>T177-CA [link_rcsr] => [in_col] => 3 [transitivity] => [3(10)(11)6] [space_group] => P-4m2 [pearson] => tP24 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T177-CA [sp_atoms] => [caid] => 601 [nn] => 1 [name] => 4<sup>3</sup>T177-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: 601 Topology: 43T177-CA # of independent nodes (IN): 3 Transitivity: [3(10)(11)6] Space Group: P-4m2 Pearson: tP24 Coordination Number (CN): 4 Year: 2021 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 |
---|---|---|---|---|---|---|---|---|
43T177-CA (SACADA #601) | 2.988 | 0.578 | 336.2 | 274.3 | 39.8 | SACADA¹ | ||
43T177-CA | doi: 10.1038/s41524-021-00491-y |
5850.4099 | 1694.1525 | 1853.0785 | -0.0000 | -0.0000 | -0.0000 |
1694.1525 | 5850.4099 | 1853.0785 | -0.0000 | -0.0000 | -0.0000 |
1853.0785 | 1853.0785 | 8115.5517 | 0.0000 | -0.0000 | -0.0000 |
-0.0000 | -0.0000 | 0.0000 | 2626.6946 | -0.0000 | -0.0000 |
-0.0000 | 0.0000 | -0.0000 | 0.0000 | 3251.5758 | -0.0000 |
-0.0000 | -0.0000 | 0.0000 | -0.0000 | -0.0000 | 3251.5759 |