Array ( [0] => Array ( [id] => 1443 [topology] => 4<sup>4</sup>T114 [link_rcsr] => [in_col] => 4 [transitivity] => [4973] [space_group] => C2/m [pearson] => mS24 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>4</sup>T114 [sp_atoms] => [caid] => 410 [nn] => 0 [name] => [pressure] => [density] => 3.278 [e_gap] => [energy] => 0.969 [bulk_mod] => 371.6 [shear_mod] => 409.8 [vicker_hard] => 76.5 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1444 [topology] => 4<sup>4</sup>T114 [link_rcsr] => [in_col] => 4 [transitivity] => [4973] [space_group] => C2/m [pearson] => mS24 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>4</sup>T114 [sp_atoms] => [caid] => 410 [nn] => 1 [name] => G104 [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: 410 Topology: 44T114 # of independent nodes (IN): 4 Transitivity: [4973] Space Group: C2/m Pearson: mS24 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 |
---|---|---|---|---|---|---|---|---|
44T114 (SACADA #410) | 3.278 | 0.969 | 371.6 | 409.8 | 76.5 | SACADA¹ | ||
G104 | doi: 10.1002/cphc.201700151 ![]() |
8653.1012 | 822.7551 | 888.9705 | 0.0000 | -0.0000 | 327.3409 |
822.7551 | 10295.8678 | 689.1146 | -0.0000 | 0.0000 | -326.0723 |
888.9705 | 689.1146 | 9757.3779 | 0.0000 | -0.0000 | -190.5443 |
0.0000 | -0.0000 | 0.0000 | 3867.1223 | -393.4079 | -0.0000 |
-0.0000 | 0.0000 | -0.0000 | -393.4079 | 3612.7596 | 0.0000 |
327.3409 | -326.0723 | -190.5443 | -0.0000 | 0.0000 | 4330.3277 |