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Array
(
    [0] => Array
        (
            [id] => 1393
            [topology] => 4<sup>8</sup>T23
            [link_rcsr] => 
            [in_col] => 8
            [transitivity] => [8(15)(11)5]
            [space_group] => C2
            [pearson] => mS28
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>8</sup>T23
            [sp_atoms] => 
            [caid] => 385
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.407
            [e_gap] => 
            [energy] => 0.881
            [bulk_mod] => 397.9
            [shear_mod] => 450.1
            [vicker_hard] => 84.5
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1394
            [topology] => 4<sup>8</sup>T23
            [link_rcsr] => 
            [in_col] => 8
            [transitivity] => [8(15)(11)5]
            [space_group] => C2
            [pearson] => mS28
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>8</sup>T23
            [sp_atoms] => 
            [caid] => 385
            [nn] => 1
            [name] => G69
            [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: 385

Topology: 48T23

# of independent nodes (IN): 8
Transitivity: [8(15)(11)5]
Space Group: C2
Pearson: mS28
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
48T23 (SACADA #385)3.4070.881397.9450.184.5SACADA¹
G69doi: 10.1002/cphc.201700151 
Elasticity tensor (kBar)¹

9726.50461244.37271020.3263-0.0000-0.0000264.8347
1244.37279355.33691224.0865-0.0000-0.0000-103.7522
1020.32631224.08659753.7347-0.0000-0.0000672.2014
-0.0000-0.0000-0.00004807.04468.5764-0.0000
-0.0000-0.0000-0.00008.57644670.6326-0.0000
264.8347-103.7522672.2014-0.0000-0.00004617.8079

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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