Array ( [0] => Array ( [id] => 1615 [topology] => 4<sup>4</sup>T122 [link_rcsr] => [in_col] => 4 [transitivity] => [4972] [space_group] => P2/m1 [pearson] => mP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>4</sup>T122 [sp_atoms] => [caid] => 496 [nn] => 0 [name] => [pressure] => [density] => 3.403 [e_gap] => [energy] => 0.881 [bulk_mod] => 415.6 [shear_mod] => 452.9 [vicker_hard] => 84.2 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1616 [topology] => 4<sup>4</sup>T122 [link_rcsr] => [in_col] => 4 [transitivity] => [4972] [space_group] => P2/m1 [pearson] => mP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>4</sup>T122 [sp_atoms] => [caid] => 496 [nn] => 1 [name] => G208 [pressure] => [density] => [e_gap] => [energy] => [bulk_mod] => [shear_mod] => [vicker_hard] => [ref_file] => /References/2017_ChemPhysChem_18_873 [publ_year] => 2017 [ref] => ) )
SACADA Database Code: 496 Topology: 44T122 # of independent nodes (IN): 4 Transitivity: [4972] Space Group: P2/m1 Pearson: mP16 Coordination Number (CN): 4 Year: 2017 ![]() ![]() |
|
Name |
Pressure, GPa |
Density, g/cm³ |
Gap, eV |
Relative energy, eV/atom |
Bulk, GPa |
Shear, GPa |
Vickers, GPa |
Refs |
---|---|---|---|---|---|---|---|---|
44T122 (SACADA #496) | 3.403 | 0.881 | 415.6 | 452.9 | 84.2 | SACADA¹ | ||
G208 | doi: 10.1002/cphc.201700151 ![]() |
9152.4444 | 1524.3722 | 1298.0167 | 3.6973 | 2.2729 | 79.5677 |
1524.3722 | 10174.2090 | 665.2004 | -0.1603 | -1.1163 | 34.0255 |
1298.0167 | 665.2004 | 11145.3910 | 5.3593 | 0.4144 | 461.1777 |
3.6973 | -0.1603 | 5.3593 | 4350.5312 | -137.4240 | -3.4315 |
2.2729 | -1.1163 | 0.4144 | -137.4240 | 4253.3473 | 0.7494 |
79.5677 | 34.0255 | 461.1777 | -3.4315 | 0.7494 | 5167.3390 |