Array ( [0] => Array ( [id] => 1491 [topology] => 4<sup>8</sup>T38 [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>T38 [sp_atoms] => [caid] => 434 [nn] => 0 [name] => [pressure] => [density] => 3.399 [e_gap] => [energy] => 0.891 [bulk_mod] => 389.5 [shear_mod] => 434.4 [vicker_hard] => 81.3 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1492 [topology] => 4<sup>8</sup>T38 [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>T38 [sp_atoms] => [caid] => 434 [nn] => 1 [name] => G134 [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: 434 Topology: 48T38 # 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 |
---|---|---|---|---|---|---|---|---|
48T38 (SACADA #434) | 3.399 | 0.891 | 389.5 | 434.4 | 81.3 | SACADA¹ | ||
G134 | doi: 10.1002/cphc.201700151 ![]() |
10825.2619 | 1017.9376 | 727.4018 | 0.0000 | 0.0000 | -146.1445 |
1017.9376 | 9092.5107 | 1416.6040 | 0.0000 | 0.0000 | -32.8405 |
727.4018 | 1416.6040 | 8885.0317 | -0.0000 | -0.0000 | 128.7542 |
0.0000 | 0.0000 | -0.0000 | 4751.0194 | -323.2259 | -0.0000 |
0.0000 | 0.0000 | -0.0000 | -323.2259 | 4469.3320 | 0.0000 |
-146.1445 | -32.8405 | 128.7542 | -0.0000 | 0.0000 | 4048.1352 |