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Array
(
    [0] => Array
        (
            [id] => 1579
            [topology] => 4<sup>7</sup>T27
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(14)(13)5]
            [space_group] => C2
            [pearson] => mS24
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T27
            [sp_atoms] => 
            [caid] => 478
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.343
            [e_gap] => 
            [energy] => 1.030
            [bulk_mod] => 371.2
            [shear_mod] => 406.1
            [vicker_hard] => 75.6
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1580
            [topology] => 4<sup>7</sup>T27
            [link_rcsr] => 
            [in_col] => 7
            [transitivity] => [7(14)(13)5]
            [space_group] => C2
            [pearson] => mS24
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>7</sup>T27
            [sp_atoms] => 
            [caid] => 478
            [nn] => 1
            [name] => G186
            [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: 478

Topology: 47T27

# of independent nodes (IN): 7
Transitivity: [7(14)(13)5]
Space Group: C2
Pearson: mS24
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
47T27 (SACADA #478)3.3431.030371.2406.175.6SACADA¹
G186doi: 10.1002/cphc.201700151 
Elasticity tensor (kBar)¹

9633.7591695.32711365.17600.0000-0.0000156.1837
695.32718527.22401061.60980.0000-0.0000-364.6046
1365.17601061.60989072.6130-0.00000.0000227.3819
0.00000.0000-0.00003818.1612-7.45440.0000
-0.0000-0.00000.0000-7.45443973.2043-0.0000
156.1837-364.6046227.38190.0000-0.00004529.3692

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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