Array ( [0] => Array ( [id] => 1415 [topology] => 4<sup>8</sup>T26 [link_rcsr] => [in_col] => 8 [transitivity] => [8(16)(11)3] [space_group] => P21 [pearson] => mP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>8</sup>T26 [sp_atoms] => [caid] => 396 [nn] => 0 [name] => [pressure] => [density] => 3.441 [e_gap] => [energy] => 0.944 [bulk_mod] => 392.5 [shear_mod] => 448.0 [vicker_hard] => 84.3 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1416 [topology] => 4<sup>8</sup>T26 [link_rcsr] => [in_col] => 8 [transitivity] => [8(16)(11)3] [space_group] => P21 [pearson] => mP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>8</sup>T26 [sp_atoms] => [caid] => 396 [nn] => 1 [name] => G87 [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: 396 Topology: 48T26 # of independent nodes (IN): 8 Transitivity: [8(16)(11)3] Space Group: P21 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 |
---|---|---|---|---|---|---|---|---|
48T26 (SACADA #396) | 3.441 | 0.944 | 392.5 | 448.0 | 84.3 | SACADA¹ | ||
G87 | doi: 10.1002/cphc.201700151 ![]() |
11078.0732 | 391.2024 | 912.1709 | 0.0000 | -0.0000 | -126.4923 |
391.2024 | 10560.2528 | 877.4820 | 0.0000 | -0.0000 | -194.8666 |
912.1709 | 877.4820 | 9369.8566 | 0.0000 | -0.0000 | -221.9000 |
0.0000 | 0.0000 | 0.0000 | 4412.5467 | -416.8966 | -0.0000 |
-0.0000 | -0.0000 | -0.0000 | -416.8966 | 4064.6447 | 0.0000 |
-126.4923 | -194.8666 | -221.9000 | -0.0000 | 0.0000 | 4395.1681 |