Array ( [0] => Array ( [id] => 1823 [topology] => 4<sup>3</sup>T176-CA [link_rcsr] => [in_col] => 3 [transitivity] => [37(10)7] [space_group] => I4/mmm [pearson] => tI48 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T176-CA [sp_atoms] => [caid] => 600 [nn] => 0 [name] => [pressure] => [density] => 3.185 [e_gap] => [energy] => 0.441 [bulk_mod] => 373.0 [shear_mod] => 343.8 [vicker_hard] => 58.1 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1824 [topology] => 4<sup>3</sup>T176-CA [link_rcsr] => [in_col] => 3 [transitivity] => [37(10)7] [space_group] => I4/mmm [pearson] => tI48 [cn] => 4 [Year] => 2021 [cn_sort] => 004- [topology_str] => 4^3T176-CA [sp_atoms] => [caid] => 600 [nn] => 1 [name] => 4<sup>3</sup>T176-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: 600 Topology: 43T176-CA # of independent nodes (IN): 3 Transitivity: [37(10)7] Space Group: I4/mmm Pearson: tI48 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 |
---|---|---|---|---|---|---|---|---|
43T176-CA (SACADA #600) | 3.185 | 0.441 | 373.0 | 343.8 | 58.1 | SACADA¹ | ||
43T176-CA | doi: 10.1038/s41524-021-00491-y ![]() |
7611.5297 | 1580.0529 | 1216.7369 | 0.0000 | 0.0000 | 0.0000 |
1580.0529 | 7611.5297 | 1216.7369 | 0.0000 | 0.0000 | 0.0000 |
1216.7369 | 1216.7369 | 10583.7304 | 0.0000 | 0.0000 | -0.0000 |
0.0000 | 0.0000 | 0.0000 | 2828.0074 | 0.0000 | 0.0000 |
0.0000 | -0.0000 | 0.0000 | 0.0000 | 3650.5149 | 0.0000 |
0.0000 | 0.0000 | 0.0000 | 0.0000 | 0.0000 | 3650.5148 |