Array ( [0] => Array ( [id] => 1411 [topology] => 4<sup>8</sup>T25 [link_rcsr] => [in_col] => 8 [transitivity] => [8(18)(15)6] [space_group] => P-1 [pearson] => aP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>8</sup>T25 [sp_atoms] => [caid] => 394 [nn] => 0 [name] => [pressure] => [density] => 3.379 [e_gap] => [energy] => 0.897 [bulk_mod] => 392.7 [shear_mod] => 425.0 [vicker_hard] => 78.9 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1412 [topology] => 4<sup>8</sup>T25 [link_rcsr] => [in_col] => 8 [transitivity] => [8(18)(15)6] [space_group] => P-1 [pearson] => aP16 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>8</sup>T25 [sp_atoms] => [caid] => 394 [nn] => 1 [name] => G85 [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: 394 Topology: 48T25 # of independent nodes (IN): 8 Transitivity: [8(18)(15)6] Space Group: P-1 Pearson: aP16 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 |
---|---|---|---|---|---|---|---|---|
48T25 (SACADA #394) | 3.379 | 0.897 | 392.7 | 425.0 | 78.9 | SACADA¹ | ||
G85 | doi: 10.1002/cphc.201700151 ![]() |
8619.0957 | 926.1545 | 1729.2971 | 412.6601 | 100.6216 | 20.7094 |
926.1545 | 10320.1174 | 927.3214 | 949.8616 | -174.7645 | 87.5873 |
1729.2971 | 927.3214 | 9278.0980 | -428.8793 | -230.1445 | -127.5969 |
412.6601 | 949.8616 | -428.8793 | 4261.9201 | 190.5521 | -85.1844 |
100.6216 | -174.7645 | -230.1445 | 190.5521 | 4451.1991 | 276.1211 |
20.7094 | 87.5873 | -127.5969 | -85.1844 | 276.1211 | 4420.7348 |