Array
(
[0] => Array
(
[id] => 1749
[topology] => 4<sup>3</sup>T60-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3543]
[space_group] => P63/mcm
[pearson] => hP24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T60-CA
[sp_atoms] =>
[caid] => 563
[nn] => 0
[name] =>
[pressure] =>
[density] => 3.363
[e_gap] =>
[energy] => 0.288
[bulk_mod] => 395.0
[shear_mod] => 406.9
[vicker_hard] => 74.1
[ref_file] =>
[publ_year] =>
[ref] =>
)
[1] => Array
(
[id] => 1750
[topology] => 4<sup>3</sup>T60-CA
[link_rcsr] =>
[in_col] => 3
[transitivity] => [3543]
[space_group] => P63/mcm
[pearson] => hP24
[cn] => 4
[Year] => 2021
[cn_sort] => 004-
[topology_str] => 4^3T60-CA
[sp_atoms] =>
[caid] => 563
[nn] => 1
[name] => 4<sup>3</sup>T60-CA
[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: 563 Topology: 43T60-CA # of independent nodes (IN): 3 Transitivity: [3543] Space Group: P63/mcm Pearson: hP24 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 |
|---|---|---|---|---|---|---|---|---|
| 43T60-CA (SACADA #563) | 3.363 | 0.288 | 395.0 | 406.9 | 74.1 | SACADA¹ | ||
| 43T60-CA | doi: 10.1038/s41524-021-00491-y |
| 10764.0074 | 1294.9179 | 763.9575 | 0.0045 | -0.0000 | -0.0000 |
| 1294.9179 | 10763.9985 | 763.9572 | 0.0045 | 0.0000 | 0.0000 |
| 763.9575 | 763.9572 | 8642.2897 | 0.0003 | 0.0000 | 0.0000 |
| 0.0045 | 0.0045 | 0.0003 | 4734.5425 | 0.0000 | 0.0000 |
| -0.0000 | 0.0000 | 0.0000 | -0.0000 | 3380.8070 | 0.0014 |
| -0.0000 | 0.0000 | 0.0000 | -0.0000 | 0.0014 | 3380.8086 |