Array ( [0] => Array ( [id] => 1340 [topology] => 4<sup>6</sup>T29 [link_rcsr] => [in_col] => 6 [transitivity] => [6(13)(13)6] [space_group] => C2 [pearson] => mS24 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>6</sup>T29 [sp_atoms] => [caid] => 359 [nn] => 0 [name] => [pressure] => [density] => 3.530 [e_gap] => [energy] => 0.819 [bulk_mod] => 421.4 [shear_mod] => 497.5 [vicker_hard] => 94.2 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1341 [topology] => 4<sup>6</sup>T29 [link_rcsr] => [in_col] => 6 [transitivity] => [6(13)(13)6] [space_group] => C2 [pearson] => mS24 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>6</sup>T29 [sp_atoms] => [caid] => 359 [nn] => 1 [name] => G7 [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: 359 Topology: 46T29 # of independent nodes (IN): 6 Transitivity: [6(13)(13)6] Space Group: C2 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 |
---|---|---|---|---|---|---|---|---|
46T29 (SACADA #359) | 3.530 | 0.819 | 421.4 | 497.5 | 94.2 | SACADA¹ | ||
G7 | doi: 10.1002/cphc.201700151 ![]() |
10952.4876 | 738.1587 | 528.4075 | 0.0000 | 0.0000 | 93.4738 |
738.1587 | 12116.1658 | 552.9464 | -0.0000 | 0.0000 | -7.0519 |
528.4075 | 552.9464 | 11254.1139 | -0.0000 | -0.0000 | -243.3041 |
0.0000 | -0.0000 | -0.0000 | 5055.1617 | -193.9497 | -0.0000 |
0.0000 | 0.0000 | -0.0000 | -193.9497 | 4926.1188 | 0.0000 |
93.4738 | -7.0519 | -243.3041 | -0.0000 | 0.0000 | 4181.7334 |