Array ( [0] => Array ( [id] => 1370 [topology] => 4<sup>3</sup>T172 [link_rcsr] => [in_col] => 3 [transitivity] => [3442] [space_group] => I222 [pearson] => oI14 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>3</sup>T172 [sp_atoms] => [caid] => 374 [nn] => 0 [name] => [pressure] => [density] => 3.157 [e_gap] => [energy] => 1.161 [bulk_mod] => 333.2 [shear_mod] => 330.0 [vicker_hard] => 58.9 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1371 [topology] => 4<sup>3</sup>T172 [link_rcsr] => [in_col] => 3 [transitivity] => [3442] [space_group] => I222 [pearson] => oI14 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>3</sup>T172 [sp_atoms] => [caid] => 374 [nn] => 1 [name] => G47 [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: 374 Topology: 43T172 # of independent nodes (IN): 3 Transitivity: [3442] Space Group: I222 Pearson: oI14 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 |
---|---|---|---|---|---|---|---|---|
43T172 (SACADA #374) | 3.157 | 1.161 | 333.2 | 330.0 | 58.9 | SACADA¹ | ||
G47 | doi: 10.1002/cphc.201700151 ![]() |
7757.0206 | 938.6585 | 862.8554 | -0.0000 | -0.0000 | -0.0000 |
938.6585 | 9191.3854 | 1091.7260 | 0.0000 | -0.0000 | 0.0000 |
862.8554 | 1091.7260 | 7396.1404 | -0.0000 | -0.0000 | -0.0000 |
0.0000 | 0.0000 | -0.0000 | 4079.5246 | -0.0000 | -0.0000 |
-0.0000 | -0.0000 | -0.0000 | 0.0000 | 1987.6145 | 0.0000 |
-0.0000 | 0.0000 | -0.0000 | -0.0000 | 0.0000 | 3865.7349 |