Array ( [0] => Array ( [id] => 1585 [topology] => 4<sup>3</sup>T183 [link_rcsr] => [in_col] => 3 [transitivity] => [3774] [space_group] => C2/c [pearson] => mS20 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>3</sup>T183 [sp_atoms] => [caid] => 481 [nn] => 0 [name] => [pressure] => [density] => 3.173 [e_gap] => [energy] => 1.199 [bulk_mod] => 344.6 [shear_mod] => 323.5 [vicker_hard] => 55.6 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1586 [topology] => 4<sup>3</sup>T183 [link_rcsr] => [in_col] => 3 [transitivity] => [3774] [space_group] => C2/c [pearson] => mS20 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>3</sup>T183 [sp_atoms] => [caid] => 481 [nn] => 1 [name] => G189 [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: 481 Topology: 43T183 # of independent nodes (IN): 3 Transitivity: [3774] Space Group: C2/c Pearson: mS20 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 |
---|---|---|---|---|---|---|---|---|
43T183 (SACADA #481) | 3.173 | 1.199 | 344.6 | 323.5 | 55.6 | SACADA¹ | ||
G189 | doi: 10.1002/cphc.201700151 ![]() |
8330.2460 | 1352.9785 | 865.6658 | 0.0000 | 0.0000 | -128.8013 |
1352.9785 | 7533.1663 | 1457.8430 | 0.0000 | 0.0000 | 349.4893 |
865.6658 | 1457.8430 | 7806.1806 | 0.0000 | -0.0000 | -933.3379 |
0.0000 | -0.0000 | 0.0000 | 2875.2936 | -44.3628 | 0.0000 |
0.0000 | -0.0000 | -0.0000 | -44.3628 | 4061.3598 | -0.0000 |
-128.8013 | 349.4893 | -933.3379 | 0.0000 | -0.0000 | 2752.1506 |