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Array
(
    [0] => Array
        (
            [id] => 1342
            [topology] => 4<sup>7</sup>T21
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(16)(12)3]
            [space_group] => P-1
            [pearson] => aP14
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T21
            [sp_atoms] => 
            [caid] => 360
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.476
            [e_gap] => 
            [energy] => 0.872
            [bulk_mod] => 404.8
            [shear_mod] => 461.2
            [vicker_hard] => 86.8
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1343
            [topology] => 4<sup>7</sup>T21
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(16)(12)3]
            [space_group] => P-1
            [pearson] => aP14
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T21
            [sp_atoms] => 
            [caid] => 360
            [nn] => 1
            [name] => G11
            [pressure] => 
            [density] => 
            [e_gap] => 
            [energy] => 
            [bulk_mod] => 
            [shear_mod] => 
            [vicker_hard] => 
            [ref_file] => /References/2017_ChemPhysChem_18_873
            [publ_year] => 2017
            [ref] => 
        )

)
General information SACADA Check your allotrope Apps Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 

SACADA Database Code: 360

Topology: 47T21

# of independent nodes (IN): 7
Transitivity: [7(16)(12)3]
Space Group: P-1
Pearson: aP14
Coordination Number (CN): 4

Year: 2017

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Style:  Wireframe   Capped sticks   Spacefill   Ball&Sticks
Labels:  No Labels   All Atoms
Translations:  {1x1x1}   {2x2x2}  {3x3x3}
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Data

Name

Pressure, GPa

Density, g/cm³

Gap, eV

Relative energy, eV/atom

Bulk, GPa

Shear, GPa

Vickers, GPa

Refs
47T21 (SACADA #360)3.4760.872404.8461.286.8SACADA¹
G11doi: 10.1002/cphc.201700151 
Elasticity tensor (kBar)¹

11045.0955795.95761096.1486194.3591-44.8639-305.6759
795.95769638.63481557.9314-183.3731278.2791213.3483
1096.14861557.93148904.059546.5300-337.8841-294.5845
194.3591-183.373146.53005003.4066-0.7939139.3459
-44.8639278.2791-337.8841-0.79394654.2929266.9364
-305.6759213.3483-294.5845139.3459266.93644840.3085

¹ We apply the density functional theory (DFT) approach by using the Vienna Ab Initio Simulation Package (VASP) to calculate the total energy and properties of carbon allotropes.

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© 2016 – 2025 SCTMS  Team References support@sacada.info Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 
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