Array ( [0] => Array ( [id] => 1348 [topology] => 4<sup>14</sup>T2 [link_rcsr] => [in_col] => 14 [transitivity] => [(14)(21)(19)(12)] [space_group] => Cm [pearson] => mS28 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>14</sup>T2 [sp_atoms] => [caid] => 363 [nn] => 0 [name] => [pressure] => [density] => 3.417 [e_gap] => [energy] => 0.679 [bulk_mod] => 408.8 [shear_mod] => 468.2 [vicker_hard] => 88.2 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 1349 [topology] => 4<sup>14</sup>T2 [link_rcsr] => [in_col] => 14 [transitivity] => [(14)(21)(19)(12)] [space_group] => Cm [pearson] => mS28 [cn] => 4 [Year] => 2017 [cn_sort] => 004- [topology_str] => 4<sup>14</sup>T2 [sp_atoms] => [caid] => 363 [nn] => 1 [name] => G14 [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: 363 Topology: 414T2 # of independent nodes (IN): 14 Transitivity: [(14)(21)(19)(12)] Space Group: Cm Pearson: mS28 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 |
---|---|---|---|---|---|---|---|---|
414T2 (SACADA #363) | 3.417 | 0.679 | 408.8 | 468.2 | 88.2 | SACADA¹ | ||
G14 | doi: 10.1002/cphc.201700151 ![]() |
11395.4113 | 382.9963 | 710.0108 | -0.0000 | -0.0000 | 322.3853 |
382.9963 | 11098.1673 | 888.4504 | -0.0000 | 0.0000 | -158.4944 |
710.0108 | 888.4504 | 10341.8307 | 0.0000 | -0.0000 | -52.9915 |
-0.0000 | -0.0000 | 0.0000 | 4495.1896 | -157.2634 | 0.0000 |
-0.0000 | 0.0000 | -0.0000 | -157.2634 | 4854.6530 | 0.0000 |
322.3853 | -158.4944 | -52.9915 | 0.0000 | 0.0000 | 3915.3275 |