Array
(
[0] => Array
(
[id] => 389
[topology] => crb
[link_rcsr] =>
[in_col] => 1
[transitivity] => [1232]
[space_group] => I4/mmm
[pearson] => tI40
[cn] => 2, 4 (4:1)
[Year] => 2013
[cn_sort] => 002-004-004-001-
[topology_str] => crb
[sp_atoms] => +
[caid] => 63
[nn] => 0
[name] =>
[pressure] =>
[density] => .864
[e_gap] =>
[energy] => 1.223
[bulk_mod] => 31.9
[shear_mod] => 1.5
[vicker_hard] => 0.2
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 390
[topology] => crb
[link_rcsr] =>
[in_col] => 1
[transitivity] => [1232]
[space_group] => I4/mmm
[pearson] => tI40
[cn] => 2, 4 (4:1)
[Year] => 2013
[cn_sort] => 002-004-004-001-
[topology_str] => crb
[sp_atoms] => +
[caid] => 63
[nn] => 1
[name] => 3-Yne
[pressure] =>
[density] =>
[e_gap] => 4.168
[energy] =>
[bulk_mod] => 40.80
[shear_mod] =>
[vicker_hard] =>
[ref_file] => /References/2013_SolidStateCommunications_169_50_56
[publ_year] => 2013
[ref] =>
)
)
|
SACADA Database Code: 63 Topology: crb (Allotrope with "sp" atoms) # of independent nodes (IN): 1 Transitivity: [1232] Space Group: I4/mmm Pearson: tI40 Coordination Number (CN): 2, 4 (4:1) Year: 2013 Download CIF File Download PDF report |
|
Name |
Pressure, GPa |
Density, g/cm³ |
Gap, eV |
Relative energy, eV/atom |
Bulk, GPa |
Shear, GPa |
Vickers, GPa |
Refs |
|---|---|---|---|---|---|---|---|---|
| crb (SACADA #63) | .864 | 1.223 | 31.9 | 1.5 | 0.2 | SACADA¹ | ||
| 3-Yne | 4.168 | 40.80 | doi: 10.1016/j.ssc.2013.07.001 |
| 705.9905 | 692.2859 | 844.5137 | 12.8522 | -10.4745 | -5.3095 |
| 692.2859 | 729.5300 | 813.2358 | 1.7367 | 13.8115 | 6.8558 |
| 844.5137 | 813.2358 | 1011.6602 | -11.7506 | -14.7153 | 2.1644 |
| 12.8522 | 1.7367 | -11.7506 | 74.8500 | 2.5500 | -2.7011 |
| -10.4745 | 13.8115 | -14.7153 | 2.5500 | 29.0649 | 0.2993 |
| -5.3095 | 6.8558 | 2.1644 | -2.7011 | 0.2993 | 29.2133 |