Array ( [0] => Array ( [id] => 90 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 0 [name] => [pressure] => [density] => 3.690 [e_gap] => [energy] => 1.647 [bulk_mod] => 447.0 [shear_mod] => 556.6 [vicker_hard] => 106.1 [ref_file] => [publ_year] => [ref] => ) [1] => Array ( [id] => 91 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 1 [name] => hP3 [pressure] => [density] => [e_gap] => 2.0 [energy] => [bulk_mod] => 432.7 [shear_mod] => [vicker_hard] => 87.6 [ref_file] => /References/2011_PhysRev_B_83_193410 [publ_year] => 2011 [ref] => ) [2] => Array ( [id] => 92 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 2 [name] => hP3 [pressure] => [density] => [e_gap] => [energy] => [bulk_mod] => [shear_mod] => [vicker_hard] => [ref_file] => /References/2012_ProgressChem24_6_1050_3DCAllotrop [publ_year] => 2012 [ref] => ) [3] => Array ( [id] => 93 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 3 [name] => hP3 [pressure] => [density] => [e_gap] => [energy] => [bulk_mod] => [shear_mod] => [vicker_hard] => [ref_file] => /References/2013_JSuperHardMat_35_1 [publ_year] => 2013 [ref] => ) [4] => Array ( [id] => 94 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 4 [name] => qtz [pressure] => [density] => [e_gap] => [energy] => [bulk_mod] => [shear_mod] => [vicker_hard] => [ref_file] => /References/2013_ZKristallogr_228_343_346 [publ_year] => 2013 [ref] => ) [5] => Array ( [id] => 95 [topology] => qtz [link_rcsr] => http://rcsr.net/nets/qtz [in_col] => 1 [transitivity] => [1121] [space_group] => P6222 [pearson] => hP3 [cn] => 4 [Year] => 2011 [cn_sort] => 004- [topology_str] => qtz [caid] => 11 [nn] => 5 [name] => cintet [pressure] => [density] => [e_gap] => [energy] => [bulk_mod] => 428 [shear_mod] => [vicker_hard] => [ref_file] => /References/2015PhysRevB91_214104 [publ_year] => 2015 [ref] => ) )
SACADA Database Code: 11 Topology: qtz # of independent nodes (IN): 1 Transitivity: [1121] Space Group: P6222 Pearson: hP3 Coordination Number (CN): 4 Year: 2011 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 |
---|---|---|---|---|---|---|---|---|
qtz (SACADA #11) | 3.690 | 1.647 | 447.0 | 556.6 | 106.1 | SACADA¹ | ||
hP3 | 2.0 | 432.7 | 87.6 | doi: 10.1103/PhysRevB.83.193410 | ||||
hP3 | link | |||||||
hP3 | doi: 10.3103/s1063457613010012 | |||||||
qtz | doi: 10.1524/zkri.2013.1620 | |||||||
cintet | 428 | doi: 10.1103/PhysRevB.91.214104 |
10559.9653 | 444.3846 | 2057.1038 | -0.0000 | 0.0000 | 0.0000 |
444.3846 | 11370.2430 | 1019.0430 | 0.0000 | 0.0000 | -0.0000 |
2057.1038 | 1019.0430 | 9252.4367 | -0.0000 | 0.0000 | 0.0000 |
-0.0000 | 0.0000 | -0.0000 | 4287.8688 | -0.0000 | -0.0000 |
0.0000 | 0.0000 | 0.0000 | -0.0000 | 5063.1620 | 0.0000 |
0.0000 | -0.0000 | -0.0000 | -0.0000 | 0.0000 | 4498.3716 |