xxx 
Array
(
    [0] => Array
        (
            [id] => 1423
            [topology] => 4<sup>8</sup>T28
            [link_rcsr] => 
            [in_col] => 8
            [transitivity] => [8(17)(13)6]
            [space_group] => C2
            [pearson] => mS32
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>8</sup>T28
            [sp_atoms] => 
            [caid] => 400
            [nn] => 0
            [name] => 
            [pressure] => 
            [density] => 3.332
            [e_gap] => 
            [energy] => 0.875
            [bulk_mod] => 377.4
            [shear_mod] => 413.9
            [vicker_hard] => 77.1
            [ref_file] => 
            [publ_year] => 
            [ref] => 
        )

    [1] => Array
        (
            [id] => 1424
            [topology] => 4<sup>8</sup>T28
            [link_rcsr] => 
            [in_col] => 8
            [transitivity] => [8(17)(13)6]
            [space_group] => C2
            [pearson] => mS32
            [cn] => 4
            [Year] => 2017
            [cn_sort] => 004-
            [topology_str] => 4<sup>8</sup>T28
            [sp_atoms] => 
            [caid] => 400
            [nn] => 1
            [name] => G91
            [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 Cite this: Angew. Chem. Int. Ed. 2016, 55, 10962–10976 

SACADA Database Code: 400

Topology: 48T28

# of independent nodes (IN): 8
Transitivity: [8(17)(13)6]
Space Group: C2
Pearson: mS32
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
48T28 (SACADA #400)3.3320.875377.4413.977.1SACADA¹
G91doi: 10.1002/cphc.201700151 
Elasticity tensor (kBar)¹

9637.59791334.01351070.79080.0000-0.000090.5360
1334.01358329.6105587.53790.0000-0.0000403.6313
1070.7908587.537910129.37510.0000-0.0000-541.6851
0.00000.00000.00004248.9559147.2297-0.0000
-0.0000-0.0000-0.0000147.22973660.27680.0000
90.5360403.6313-541.6851-0.00000.00004511.9301

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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