Array
(
[0] => Array
(
[id] => 204
[topology] => pcu-h
[link_rcsr] =>
[in_col] => 2
[transitivity] => [1221]
[space_group] => R-3m
[pearson] => hR36
[cn] => 2, 3 (1:1)
[Year] => 2016
[cn_sort] => 002-003-001-001-
[topology_str] => pcu-h
[sp_atoms] => +
[caid] => 27
[nn] => 0
[name] =>
[pressure] =>
[density] => 1.770
[e_gap] =>
[energy] => 0.711
[bulk_mod] => 108.1
[shear_mod] => 38.0
[vicker_hard] => 5.7
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 205
[topology] => pcu-h
[link_rcsr] =>
[in_col] => 2
[transitivity] => [1221]
[space_group] => R-3m
[pearson] => hR36
[cn] => 2, 3 (1:1)
[Year] => 2016
[cn_sort] => 002-003-001-001-
[topology_str] => pcu-h
[sp_atoms] => +
[caid] => 27
[nn] => 1
[name] => Rh12
[pressure] =>
[density] =>
[e_gap] => Metal
[energy] =>
[bulk_mod] => 195
[shear_mod] =>
[vicker_hard] =>
[ref_file] => /References/2016_SciRep_6_24665
[publ_year] => 2016
[ref] =>
)
)
|
SACADA Database Code: 27 Topology: pcu-h (Allotrope with "sp" atoms) # of independent nodes (IN): 2 Transitivity: [1221] Space Group: R-3m Pearson: hR36 Coordination Number (CN): 2, 3 (1:1) Year: 2016 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 |
|---|---|---|---|---|---|---|---|---|
| pcu-h (SACADA #27) | 1.770 | 0.711 | 108.1 | 38.0 | 5.7 | SACADA¹ | ||
| Rh12 | Metal | 195 | doi: 10.1038/srep24665 |
| 4851.1263 | 2648.7743 | 332.1053 | -6.5036 | 235.5026 | -10.5297 |
| 2648.7743 | 4921.7637 | 358.1626 | 28.4443 | -247.6548 | 10.3718 |
| 332.1053 | 358.1626 | 300.8528 | 5.7351 | -0.8451 | -1.3428 |
| -6.5036 | 28.4443 | 5.7351 | 1002.8804 | 10.4359 | 190.9582 |
| 235.5026 | -247.6548 | -0.8451 | 10.4359 | 89.2211 | 3.0845 |
| -10.5297 | 10.3718 | -1.3428 | 190.9582 | 3.0845 | 74.1427 |