Array ( [0] => Array ( [id] => 1459 [topology] => 4<sup>16</sup>T9 [link_rcsr] => [in_col] => 16 [transitivity] => [(16)(32)(23)7] [space_group] => P1 [pearson] => aP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>16</sup>T9 [sp_atoms] => [caid] => 418 [nn] => 0 [name] => [pressure] => [density] => 3.373 [e_gap] => [energy] => 0.932 [bulk_mod] => 388.5 [shear_mod] => 415.7 [vicker_hard] => 76.9 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1460 [topology] => 4<sup>16</sup>T9 [link_rcsr] => [in_col] => 16 [transitivity] => [(16)(32)(23)7] [space_group] => P1 [pearson] => aP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>16</sup>T9 [sp_atoms] => [caid] => 418 [nn] => 1 [name] => G118 [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: 418 Topology: 416T9 # of independent nodes (IN): 16 Transitivity: [(16)(32)(23)7] Space Group: P1 Pearson: aP16 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 |
---|---|---|---|---|---|---|---|---|
416T9 (SACADA #418) | 3.373 | 0.932 | 388.5 | 415.7 | 76.9 | SACADA¹ | ||
G118 | doi: 10.1002/cphc.201700151 ![]() |
8568.6584 | 1410.1410 | 1448.0929 | -191.5358 | 191.4486 | -107.4094 |
1410.1410 | 9383.9378 | 904.6387 | -56.8463 | -483.7495 | -160.7792 |
1448.0929 | 904.6387 | 9566.4387 | 150.1639 | -478.1481 | -20.8326 |
-191.5358 | -56.8463 | 150.1639 | 4478.2604 | -57.3602 | -79.3247 |
191.4486 | -483.7495 | -478.1481 | -57.3602 | 4044.2037 | 7.8444 |
-107.4094 | -160.7792 | -20.8326 | -79.3247 | 7.8444 | 4465.5778 |