Array
(
[0] => Array
(
[id] => 3006
[topology] => mot-e
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2243]
[space_group] => P4/mmm
[pearson] => tP6
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => mot-e
[sp_atoms] =>
[caid] => 1184
[nn] => 0
[name] =>
[pressure] =>
[density] => 2.749
[e_gap] =>
[energy] => 1.724
[bulk_mod] => 268.9
[shear_mod] => 113.2
[vicker_hard] => 16.0
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 3007
[topology] => mot-e
[link_rcsr] =>
[in_col] => 2
[transitivity] => [2243]
[space_group] => P4/mmm
[pearson] => tP6
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => mot-e
[sp_atoms] =>
[caid] => 1184
[nn] => 1
[name] => mot-e
[pressure] =>
[density] =>
[e_gap] =>
[energy] =>
[bulk_mod] =>
[shear_mod] =>
[vicker_hard] =>
[ref_file] => /References/2021_npjComputMater_7_15
[publ_year] => 2021
[ref] => doi: <a href="http://doi.org/10.1038/s41524-021-00491-y" target="_blank">10.1038/s41524-021-00491-y</a>
)
)
|
SACADA Database Code: 1184 Topology: mot-e # of independent nodes (IN): 2 Transitivity: [2243] Space Group: P4/mmm Pearson: tP6 Coordination Number (CN): 4 Year: 2021 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 |
|---|---|---|---|---|---|---|---|---|
| mot-e (SACADA #1184) | 2.749 | 1.724 | 268.9 | 113.2 | 16.0 | SACADA¹ | ||
| mot-e | doi: 10.1038/s41524-021-00491-y |
| 4531.4133 | 1611.2784 | 839.5995 | -0.0000 | -0.0000 | -0.0000 |
| 1611.2784 | 4531.4133 | 839.5995 | 0.0000 | -0.0000 | 0.0000 |
| 839.5995 | 839.5995 | 9305.2666 | 0.0000 | 0.0000 | -0.0000 |
| 0.0000 | 0.0000 | -0.0000 | 479.7685 | -0.0000 | 0.0000 |
| -0.0000 | -0.0000 | 0.0000 | -0.0000 | 741.1403 | -0.0000 |
| -0.0000 | 0.0000 | -0.0000 | 0.0000 | -0.0000 | 741.1396 |